data_1k85_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 1k85 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 559' ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.671 0.272 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.49 -177.55 2.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.538 2.159 . . . . 0.0 112.436 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 69.5 p -91.98 155.78 17.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.105 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.605 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -83.08 127.03 70.86 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.426 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.3 Cg_exo -48.34 138.42 23.55 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.542 2.161 . . . . 0.0 111.683 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 52.5 p -128.28 162.47 26.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.524 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 59.38 54.38 4.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.598 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.763 HD13 ' HG ' ' A' ' 578' ' ' LEU . 65.5 tp -69.68 160.78 30.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -160.88 176.05 11.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.996 0.426 . . . . 0.0 111.581 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 70.8 p -136.52 122.81 20.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.461 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 7.0 p -99.42 -88.04 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.19 131.5 34.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.075 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.472 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -150.49 113.65 4.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.825 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.8 p -95.84 -153.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.99 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.2 p -97.62 22.41 9.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.488 ' O ' HD13 ' A' ' 614' ' ' LEU . 86.9 p -166.15 -46.51 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.502 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.34 133.59 50.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.213 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.472 HG13 ' HB2' ' A' ' 571' ' ' GLN . 21.5 tt -124.33 153.17 30.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.043 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.7 m -122.95 121.68 36.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.763 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -105.72 149.47 26.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.452 -179.307 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.83 143.83 41.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.112 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.518 ' HB3' HD11 ' A' ' 566' ' ' LEU . 47.6 p90 -158.55 169.98 23.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.924 0.392 . . . . 0.0 111.483 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.93 128.88 33.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.26 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . 0.511 ' HA ' ' HH ' ' A' ' 592' ' ' TYR . . . -63.99 155.09 32.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.05 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 16.4 m -65.07 142.34 58.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.91 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 6.8 m -64.44 -17.49 63.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.047 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -112.75 143.57 43.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.957 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -152.33 42.55 0.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -17.47 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.186 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -152.32 -4.0 0.16 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.551 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 12.1 t -64.57 149.44 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.755 0.312 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 39.7 p -124.3 -51.5 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.417 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -153.86 -171.91 21.4 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.904 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.511 ' HH ' ' HA ' ' A' ' 582' ' ' ALA . 87.4 m-85 -121.52 175.7 6.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.855 0.36 . . . . 0.0 110.975 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.453 ' HB3' HD23 ' A' ' 600' ' ' LEU . 3.6 m-20 -140.21 131.92 27.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.677 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.52 ' HB ' HG22 ' A' ' 602' ' ' THR . 43.1 t -99.9 126.23 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.205 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.428 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 41.3 m-85 -99.97 129.47 46.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -106.55 84.77 2.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.542 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.91 -86.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.341 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -143.63 11.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.912 0.387 . . . . 0.0 111.054 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -137.0 151.1 48.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.09 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -60.32 136.02 57.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.428 ' H ' HD21 ' A' ' 600' ' ' LEU . . . -113.06 -101.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.497 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.52 HG22 ' HB ' ' A' ' 594' ' ' VAL . 12.2 t -88.85 176.93 6.84 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.789 0.328 . . . . 0.0 111.425 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -140.58 140.03 35.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.931 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.459 HG13 ' HA ' ' A' ' 609' ' ' ALA . 2.9 m -140.39 177.48 4.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.496 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.417 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 1.4 p -144.57 3.26 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.018 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.63 -132.02 6.1 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 4.71 13.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.689 0.28 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 36.8 p -129.89 -178.98 4.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.459 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -153.78 147.8 25.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.996 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.3 m -127.76 122.43 32.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . . . . . . . . . 3.5 mt -121.68 118.11 54.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.976 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -102.84 175.24 5.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.866 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.58 70.76 0.99 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.498 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 574' ' ' SER . 8.5 mt -136.93 122.46 19.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.762 0.315 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -73.37 143.92 46.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.29 161.4 29.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.384 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.73 44.31 26.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.283 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.1 m -140.12 152.43 46.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.321 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.2 t -89.24 134.03 34.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -137.78 122.82 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.257 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 64.0 p -103.1 124.22 48.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -119.21 162.38 18.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.104 0.478 . . . . 0.0 111.732 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.45 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 0.8 OUTLIER -155.35 179.49 9.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.258 179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.486 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -138.54 147.26 25.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.004 0.43 . . . . 0.0 111.596 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.485 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 3.2 mmtp -141.02 120.21 12.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.38 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.547 ' HB2' ' HG ' ' A' ' 634' ' ' SER . . . -80.13 138.45 36.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.634 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HG2' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -124.77 161.93 25.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.881 0.372 . . . . 0.0 111.312 -179.725 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER -123.7 155.31 38.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.661 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.34 51.66 2.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.189 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.13 3.22 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.172 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 92.28 42.87 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.55 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.45 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . 5.4 m120 -134.28 119.47 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.788 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.37 148.3 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 0.0 111.34 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.547 ' HG ' ' HB2' ' A' ' 626' ' ' ALA . 13.3 p -90.25 -165.94 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.605 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -90.29 176.18 6.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.714 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.485 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -89.96 146.76 24.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.044 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 6.6 p -81.15 -174.02 4.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.884 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.17 146.64 54.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.555 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 123.17 27.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.489 ' CG2' HD21 ' A' ' 566' ' ' LEU . 4.9 m -100.79 106.88 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.98 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.55 95.03 8.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.955 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.428 ' H ' HG23 ' A' ' 642' ' ' VAL . 0.0 OUTLIER -106.38 136.36 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.081 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.33 114.54 28.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.79 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.201 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.549 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.675 0.274 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.76 -159.86 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.668 2.245 . . . . 0.0 112.467 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 138.94 50.41 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.104 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -70.98 132.3 86.73 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.23 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.435 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.2 Cg_exo -45.75 155.91 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.77 2.313 . . . . 0.0 112.116 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 70.2 p -136.52 149.96 48.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.997 0.427 . . . . 0.0 111.742 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 59.36 65.01 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.004 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.791 HD13 ' HG ' ' A' ' 578' ' ' LEU . 1.1 tp -88.48 152.64 21.75 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.627 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -178.77 6.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.952 0.406 . . . . 0.0 111.341 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.36 127.38 39.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.309 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.82 -86.16 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.326 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.46 97.94 10.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.547 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -117.54 109.83 17.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.505 ' HG1' ' H ' ' A' ' 575' ' ' SER . 53.6 p -90.32 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 34.4 p -89.76 5.52 45.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.412 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 20.2 p -140.35 -48.1 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.505 ' H ' ' HG1' ' A' ' 572' ' ' THR . 0.0 OUTLIER -106.91 165.05 11.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.74 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.547 HG13 ' HB2' ' A' ' 571' ' ' GLN . 20.3 tt -150.55 146.23 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.359 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 85.0 m -109.17 123.65 49.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.791 ' HG ' HD13 ' A' ' 566' ' ' LEU . 1.1 tp -111.43 131.24 55.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.7 t -127.05 137.55 53.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.382 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.466 ' HB3' HD11 ' A' ' 566' ' ' LEU . 45.6 p90 -154.52 169.74 23.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.143 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.1 m -88.01 129.43 35.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.994 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.74 165.09 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.9 166.57 13.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.033 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -1.4 53.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.836 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -117.95 64.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.437 ' C ' ' H ' ' A' ' 588' ' ' GLY . 34.4 t30 -70.9 -153.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.611 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' A' ' 586' ' ' ASN . 47.3 t 74.98 -37.74 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -108.98 -28.09 4.59 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.854 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.8 t -68.87 124.26 24.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.607 0.241 . . . . 0.0 110.585 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 18.4 p -123.38 1.15 8.99 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.746 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.18 168.72 40.67 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.193 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -131.08 162.21 30.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.787 0.327 . . . . 0.0 110.602 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.45 ' OD1' HG21 ' A' ' 603' ' ' THR . 48.2 m-20 -126.83 135.44 51.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.868 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 47.2 t -100.15 129.07 51.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.25 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.441 ' CE2' ' HG3' ' A' ' 625' ' ' LYS . 33.7 m-85 -107.29 129.63 54.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.723 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -123.91 94.23 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 60.11 72.05 0.68 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.507 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 8.2 p 46.12 34.48 2.11 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.907 0.384 . . . . 0.0 111.356 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.51 107.9 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.759 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 3.9 tt -52.36 122.83 9.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.078 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.458 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -91.81 -95.27 0.13 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.247 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.458 ' H ' ' HB2' ' A' ' 601' ' ' ALA . 7.6 t -90.73 177.01 6.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.104 0.478 . . . . 0.0 111.79 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.45 HG21 ' OD1' ' A' ' 593' ' ' ASP . 7.5 m -140.61 134.17 30.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.545 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 11.4 m -136.67 -173.45 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.956 0.408 . . . . 0.0 111.589 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.746 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.6 p -131.81 -25.32 2.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.999 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -92.98 -151.19 27.64 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.484 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 17.7 p -100.41 12.94 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.843 0.354 . . . . 0.0 111.209 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.91 155.43 45.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.988 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.424 ' HB1' ' CH2' ' A' ' 580' ' ' TRP . . . -144.79 155.18 43.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.67 113.99 11.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.3 mp -99.78 113.84 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.671 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 13.3 p -101.94 132.26 47.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.913 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.48 1.34 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.491 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.7 mt -137.0 114.35 10.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.768 0.318 . . . . 0.0 110.693 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -67.33 128.49 36.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -64.1 175.14 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.271 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 25.7 t70 57.09 30.39 18.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.07 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.4 m -140.18 144.74 36.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.45 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.87 134.45 33.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.396 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -127.8 139.32 52.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 111.443 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.1 p -117.96 117.9 30.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.11 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.436 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 68.2 m-85 -106.68 171.31 7.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.328 0.585 . . . . 0.0 112.164 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.91 173.67 8.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.102 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.442 HG22 HD12 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -139.68 150.14 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.981 0.419 . . . . 0.0 111.448 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 634' ' ' SER . 7.6 mttt -140.54 123.46 16.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.203 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.418 ' O ' HG22 ' A' ' 633' ' ' VAL . . . -81.03 134.85 35.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.308 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -131.63 149.9 52.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.831 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -111.73 -179.6 3.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.12 43.07 1.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.041 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.52 5.27 0.61 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.208 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 86.95 9.27 74.36 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.462 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.549 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.7 m-80 -93.43 116.95 29.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 626' ' ' ALA . 5.9 p -125.06 135.38 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.445 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.56 -160.34 0.15 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.993 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.48 -177.08 4.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -89.93 136.77 32.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.15 -174.27 1.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.778 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.31 142.64 42.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -88.13 126.19 34.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.097 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.638 HG12 HD21 ' A' ' 566' ' ' LEU . 10.2 p -101.02 124.86 54.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 3.4 p -95.96 89.85 5.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.867 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.56 132.27 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.61 133.66 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 111.126 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.088 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.676 0.274 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.5 ' HB2' ' H ' ' A' ' 561' ' ' THR . 83.7 Cg_endo -79.11 -139.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.721 2.281 . . . . 0.0 112.456 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.5 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -114.22 134.78 54.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.864 0.364 . . . . 0.0 111.048 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.599 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -78.46 130.11 72.47 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.455 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.419 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 52.0 Cg_exo -54.23 171.57 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.68 2.253 . . . . 0.0 112.042 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.8 t -163.6 164.25 24.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.28 34.62 24.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.3 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.769 HD13 ' HG ' ' A' ' 578' ' ' LEU . 35.8 tp -60.92 158.83 12.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.468 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.63 -177.54 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.263 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' SER . . . . . 0.569 ' HG ' ' HG2' ' A' ' 571' ' ' GLN . 5.3 t -144.89 126.97 15.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.066 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 17.8 p -99.78 -81.02 0.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.545 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -83.3 104.28 13.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.584 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.569 ' HG2' ' HG ' ' A' ' 568' ' ' SER . 0.0 OUTLIER -120.17 89.85 3.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.459 179.457 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 79.5 p -80.96 -158.8 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 63.1 p -94.57 22.86 5.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.61 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.479 ' O ' HD12 ' A' ' 614' ' ' LEU . 2.9 p -168.74 -44.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.706 0.288 . . . . 0.0 111.458 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.402 ' HB3' ' HG ' ' A' ' 612' ' ' SER . 0.3 OUTLIER -106.25 138.78 41.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.537 HD13 HG12 ' A' ' 642' ' ' VAL . 9.5 tt -130.26 148.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -116.29 109.8 17.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.769 ' HG ' HD13 ' A' ' 566' ' ' LEU . 1.3 tp -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.899 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' SER . . . . . 0.433 ' O ' HD11 ' A' ' 566' ' ' LEU . 34.8 t -130.82 139.97 50.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.667 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.419 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 40.2 p90 -151.84 170.07 20.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 0.0 111.255 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.5 m -79.96 135.35 36.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.057 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.51 173.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 p -76.56 155.6 33.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.852 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 71.3 p -91.45 18.21 7.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -126.46 -69.34 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 55.11 30.81 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.031 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.52 -12.09 9.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.021 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -156.63 -4.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.428 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.8 t -62.58 133.2 28.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.7 0.286 . . . . 0.0 111.179 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.485 HG22 ' HE3' ' A' ' 627' ' ' LYS . 1.3 t -112.47 -24.05 9.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.175 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -170.96 -177.85 41.13 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.665 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -126.66 133.66 50.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.833 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.27 117.43 34.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.502 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.586 HG11 HG21 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.38 132.66 44.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.902 0.382 . . . . 0.0 111.067 -179.719 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -99.43 170.38 8.66 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.036 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -140.23 85.6 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.319 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.18 -67.38 2.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.984 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -155.5 -9.04 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.824 0.345 . . . . 0.0 110.998 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.12 132.96 55.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.351 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -98.65 -105.67 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.87 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.586 HG21 HG11 ' A' ' 594' ' ' VAL . 3.9 t -90.77 173.18 8.15 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.962 0.411 . . . . 0.0 111.497 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 4.9 m -139.09 126.97 22.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.654 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.457 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 13.9 m -126.45 -169.1 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.368 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.53 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 7.2 p -137.36 2.01 2.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.208 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -126.3 -147.47 6.85 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.424 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 81.5 p -105.12 25.92 9.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.347 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.573 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.6 OUTLIER -146.5 127.31 14.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.096 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.457 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -119.93 140.36 51.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.157 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -116.85 115.05 24.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.506 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.9 mt -114.12 110.46 32.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.189 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 612' ' ' SER . . . . . 0.402 ' HG ' ' HB3' ' A' ' 575' ' ' SER . 0.5 OUTLIER -112.5 158.52 19.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.769 179.787 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.48 29.59 9.3 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.617 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 574' ' ' SER . 6.0 mt -91.4 -173.91 3.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.764 0.316 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -123.18 120.31 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.06 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -57.9 159.78 5.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.94 37.39 28.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.165 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.4 m -140.13 146.54 38.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.255 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 28.1 t -89.47 139.34 30.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.638 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -140.15 125.35 18.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 111.254 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.44 123.87 46.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.519 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -115.66 169.08 9.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.244 0.545 . . . . 0.0 111.829 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -159.28 159.62 34.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.59 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.767 HG23 HD21 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -121.12 148.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.132 0.491 . . . . 0.0 111.948 -179.508 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -140.35 157.89 44.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.688 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.68 141.24 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.413 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.485 ' HE3' HG22 ' A' ' 590' ' ' THR . 0.0 OUTLIER -131.16 153.71 49.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.784 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.51 174.78 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.942 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.65 56.3 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.85 -42.31 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.178 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.79 2.95 1.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.472 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -86.81 144.89 26.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 110.849 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 9.8 m -136.03 148.89 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.366 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.6 OUTLIER -87.18 -161.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.788 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.599 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.06 169.46 11.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 111.012 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.97 140.25 30.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.426 ' HB3' HG21 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -78.84 -173.5 3.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.447 ' ND2' ' HB3' ' A' ' 566' ' ' LEU . 0.9 OUTLIER -60.28 155.07 18.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.83 154.08 27.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.096 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.93 109.12 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.108 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.52 111.16 22.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.706 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.537 HG12 HD13 ' A' ' 576' ' ' ILE . 0.9 OUTLIER -112.55 152.41 14.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.989 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -113.98 106.5 14.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.021 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.652 0.263 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 634' ' ' SER . 74.4 Cg_endo -73.52 -148.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 583' ' ' SER . 0.1 OUTLIER -119.0 128.25 54.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.934 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.13 128.73 91.34 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.246 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.431 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 80.3 Cg_exo -45.16 145.67 3.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.698 2.266 . . . . 0.0 112.086 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 32.8 p -127.82 156.16 42.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.37 . . . . 0.0 111.685 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.08 60.75 3.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.71 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' A' ' 580' ' ' TRP . 13.0 tp -79.29 158.29 27.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.57 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.69 175.07 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 0.0 111.673 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 13.7 p -127.03 128.94 47.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.267 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.5 p -99.57 -84.55 0.41 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.359 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.36 148.89 25.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.368 . . . . 0.0 111.167 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 136.78 8.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.732 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.474 ' HG1' ' H ' ' A' ' 575' ' ' SER . 31.9 p -134.22 -155.3 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.12 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.423 ' H ' ' HB ' ' A' ' 572' ' ' THR . 0.0 OUTLIER -95.28 20.73 8.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.301 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 12.9 p -167.06 -41.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.51 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -109.75 155.85 21.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.275 -179.45 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.584 HG22 ' HB ' ' A' ' 611' ' ' ILE . 15.0 tt -159.26 134.98 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 111.242 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 55.6 m -104.46 141.7 35.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.962 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 608' ' ' THR . 54.6 mt -123.7 146.06 48.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 51.9 p -133.39 127.16 32.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.733 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.586 ' HB3' HD11 ' A' ' 566' ' ' LEU . 46.8 p90 -137.21 169.6 17.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.172 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.7 m -87.12 138.09 31.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.129 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.76 166.5 2.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.222 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.567 ' HB2' HG22 ' A' ' 561' ' ' THR . 34.9 p -73.61 -3.67 29.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.928 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 59.34 16.29 4.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.077 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -148.27 68.18 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.592 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.0 25.24 0.58 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.196 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.01 -19.27 21.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.985 0.422 . . . . 0.0 110.661 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -149.69 -14.81 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.242 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 17.3 t -66.02 144.29 14.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.778 0.323 . . . . 0.0 111.065 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.571 HG23 ' HB3' ' A' ' 629' ' ' ALA . 75.4 p -123.74 -48.7 1.9 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.281 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.581 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -140.44 -174.68 14.04 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.787 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -133.81 154.84 50.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.683 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -121.73 137.71 54.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.952 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.506 ' HB ' HG22 ' A' ' 602' ' ' THR . 56.1 t -104.19 128.42 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.755 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.556 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 40.7 m-85 -102.2 126.84 49.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.305 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -99.02 84.32 3.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.225 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 82.84 -72.53 2.82 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.226 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 17.2 p -147.45 3.41 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.663 0.268 . . . . 0.0 111.265 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -121.75 173.96 7.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.453 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -90.3 119.15 30.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.638 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.409 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -92.83 -104.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.364 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.506 HG22 ' HB ' ' A' ' 594' ' ' VAL . 15.1 t -90.64 173.49 8.02 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 111.616 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 3.1 m -139.52 119.76 13.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.511 HG13 ' HA ' ' A' ' 609' ' ' ALA . 12.7 m -122.41 -172.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.506 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.581 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 27.7 p -141.6 -10.04 0.93 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.098 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -102.07 -123.8 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.61 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 26.3 p -122.12 -13.12 8.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.713 0.292 . . . . 0.0 111.245 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 27.3 p -105.58 172.74 6.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.081 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.511 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -152.74 155.14 36.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.187 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -129.95 117.17 19.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.209 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.584 ' HB ' HG22 ' A' ' 576' ' ' ILE . 5.7 mt -115.84 109.82 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.013 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.8 m -107.66 155.37 20.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.839 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 90.65 54.52 2.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.538 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.9 mt -118.82 144.16 46.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.88 0.372 . . . . 0.0 110.937 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -94.91 137.91 33.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.028 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -68.11 162.08 25.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.422 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 55.51 43.3 28.74 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.307 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 618' ' ' THR . . . . . 0.432 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 5.6 m -140.65 146.56 38.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.34 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.6 t -91.16 120.38 32.05 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.527 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . 0.432 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 74.8 m-85 -121.63 129.32 52.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.957 0.408 . . . . 0.0 111.524 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 64.0 p -104.33 141.02 37.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.92 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.629 ' H ' HG12 ' A' ' 640' ' ' VAL . 32.1 m-85 -129.31 169.05 15.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.274 0.559 . . . . 0.0 112.09 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.85 168.18 16.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.057 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.456 HG22 HD11 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -137.8 153.45 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.065 0.46 . . . . 0.0 111.56 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.556 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 1.4 mttp -140.41 149.95 43.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.92 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -105.18 136.92 43.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.88 149.77 50.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.116 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.439 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 1.8 m-20 -107.14 167.36 9.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.651 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . 0.571 ' HB3' HG23 ' A' ' 590' ' ' THR . . . -78.25 -8.92 58.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.149 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -92.56 -9.99 39.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 97.27 54.28 1.28 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.71 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.93 131.68 31.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.779 0.323 . . . . 0.0 110.975 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 24.9 t -126.32 132.79 70.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.253 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.561 ' HB2' ' HG2' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -79.28 -157.48 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 179.656 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -89.34 177.23 6.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.872 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.458 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -86.26 143.51 27.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -73.24 -170.13 0.73 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.35 146.87 42.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.632 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.06 134.33 36.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.219 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.629 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -99.78 154.43 4.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.935 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.03 81.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.434 ' H ' HG11 ' A' ' 642' ' ' VAL . 3.3 p -100.04 132.31 45.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.898 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -105.54 111.92 24.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.244 179.976 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.602 0.239 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.445 ' HG2' ' HB3' ' A' ' 634' ' ' SER . 40.2 Cg_endo -65.95 173.97 6.37 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.481 2.121 . . . . 0.0 112.236 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 1.4 p -84.97 127.43 34.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.049 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.622 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -63.86 127.28 91.45 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.042 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -46.18 133.61 15.22 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.657 2.238 . . . . 0.0 112.039 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 27.7 p -117.15 153.4 32.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.658 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 58.95 77.35 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.773 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.794 HD11 ' HG ' ' A' ' 578' ' ' LEU . 24.6 tp -83.7 162.4 20.73 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.546 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -159.22 167.31 29.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.0 111.672 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 80.2 p -128.71 136.37 50.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.53 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -112.07 -88.13 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.504 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.96 108.69 19.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.451 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.472 ' H ' HE21 ' A' ' 571' ' ' GLN . 0.0 OUTLIER -119.91 98.9 6.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.832 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.485 ' HG1' ' H ' ' A' ' 574' ' ' SER . 30.5 p -86.63 -152.54 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.859 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.485 ' HB ' ' HB1' ' A' ' 616' ' ' ALA . 30.4 p -101.56 -10.77 19.81 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.687 0.255 . . . . 0.0 111.687 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.485 ' H ' ' HG1' ' A' ' 572' ' ' THR . 76.2 p -125.71 -33.86 2.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -123.44 159.43 29.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.945 0.403 . . . . 0.0 111.171 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.475 HD11 HG21 ' A' ' 642' ' ' VAL . 11.0 tt -142.07 151.42 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 5.5 m -118.82 127.62 53.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.794 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -121.39 137.87 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.332 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 37.5 t -128.6 146.76 50.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.282 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.498 ' HB3' HD12 ' A' ' 566' ' ' LEU . 48.1 p90 -157.79 170.07 23.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.924 0.392 . . . . 0.0 111.323 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.74 125.51 29.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.233 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.34 153.14 35.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.347 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.641 ' H ' ' HH ' ' A' ' 592' ' ' TYR . 1.7 p -70.72 169.72 13.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.789 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.22 -19.19 20.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.959 0.409 . . . . 0.0 111.114 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -89.03 37.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.767 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -58.46 -13.31 5.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.2 3.45 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.059 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -143.65 -24.73 0.16 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 10.2 t -61.24 144.98 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 111.066 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 16.6 p -124.69 -9.96 7.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.286 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.615 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.03 172.45 36.54 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.513 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.641 ' HH ' ' H ' ' A' ' 583' ' ' SER . 80.7 m-85 -124.65 134.12 53.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 111.16 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.409 ' HB3' HD12 ' A' ' 600' ' ' LEU . 78.8 m-20 -100.94 135.84 41.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.451 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.552 ' HB ' HG21 ' A' ' 602' ' ' THR . 97.8 t -101.75 135.13 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.6 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 57.0 m-85 -112.6 129.5 56.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.647 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -122.06 107.85 12.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 57.88 59.59 10.55 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.291 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.1 p 52.64 33.24 13.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.949 0.404 . . . . 0.0 111.327 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.81 111.6 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -47.81 153.67 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.623 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.419 ' HB1' ' H ' ' A' ' 602' ' ' THR . . . -134.93 -86.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.307 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.629 HG22 HG13 ' A' ' 611' ' ' ILE . 14.6 t -90.5 171.24 9.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.191 0.52 . . . . 0.0 111.85 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 46.5 m -140.36 123.53 16.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.494 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.27 -169.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.926 0.393 . . . . 0.0 111.549 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.615 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.1 p -142.0 -31.55 0.54 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.964 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -76.26 -125.22 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.435 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 16.7 p -122.84 -13.09 7.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.734 0.302 . . . . 0.0 111.159 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 50.0 p -108.67 155.71 20.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.021 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -139.35 145.28 38.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.4 m -127.01 119.76 27.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.2 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.629 HG13 HG22 ' A' ' 602' ' ' THR . 3.6 mp -104.75 139.51 25.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.936 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.83 163.74 16.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 80.6 39.27 14.78 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.509 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -96.55 162.76 13.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 110.996 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -125.46 127.03 45.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.913 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.485 ' HB1' ' HB ' ' A' ' 573' ' ' THR . . . -59.31 160.12 6.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.447 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.83 43.66 30.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.207 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.7 m -140.42 146.46 38.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.396 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 6.0 t -86.92 137.54 32.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.472 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -140.12 131.14 26.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.015 0.436 . . . . 0.0 112.113 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.486 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -106.31 130.33 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.482 178.647 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -123.17 166.96 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.375 0.607 . . . . 0.0 112.548 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.09 160.48 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.822 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.25 150.95 34.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.098 0.475 . . . . 0.0 111.574 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.514 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.9 mmtt -140.18 149.73 43.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.872 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.461 ' O ' HG22 ' A' ' 633' ' ' VAL . . . -110.63 150.42 29.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.747 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 141.81 39.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.752 0.311 . . . . 0.0 111.208 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -108.04 165.23 11.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.29 9.98 21.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -96.19 -0.04 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.075 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 90.22 27.77 19.68 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.489 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -128.1 159.68 34.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.721 0.296 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 626' ' ' ALA . 2.6 p -139.53 145.97 26.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.349 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.445 ' HB3' ' HG2' ' A' ' 560' ' ' PRO . 51.4 p -82.71 -174.81 5.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.622 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -90.28 178.69 6.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.995 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.514 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -88.0 142.95 27.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 2.4 p -77.2 -166.8 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.216 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.02 140.35 45.37 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.787 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.72 119.52 22.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.814 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.486 ' O ' ' HA ' ' A' ' 621' ' ' THR . 8.7 p -99.88 138.36 24.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.165 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.9 t -107.13 89.15 2.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.699 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.475 HG21 HD11 ' A' ' 576' ' ' ILE . 3.7 m -110.02 141.15 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.595 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -95.97 163.17 13.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.653 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 616' ' ' ALA . 4.9 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.224 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.63 0.253 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.408 ' HB2' ' H ' ' A' ' 561' ' ' THR . 90.4 Cg_endo -76.94 -149.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.593 2.196 . . . . 0.0 112.256 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.422 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -113.97 114.49 26.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.046 179.786 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -60.58 128.89 88.99 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.983 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.24 151.77 4.14 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.492 2.128 . . . . 0.0 111.899 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.55 156.09 45.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 59.09 45.53 14.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.725 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.594 HD23 HG23 ' A' ' 624' ' ' VAL . 48.8 tp -66.71 156.7 34.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.426 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.11 168.87 21.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 59.9 p -124.04 143.93 50.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.156 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 14.9 p -125.05 -86.35 0.63 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.578 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.573 ' HB3' ' HG1' ' A' ' 577' ' ' THR . . . -81.79 98.89 8.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 111.194 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.439 HE21 ' HB2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -118.28 102.4 8.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.86 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 15.1 p -87.87 -152.02 0.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.842 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.3 p -100.83 -22.65 14.78 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.672 0.272 . . . . 0.0 111.627 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.0 p -122.22 -7.63 8.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.318 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.19 165.18 27.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.898 0.38 . . . . 0.0 111.038 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.444 HG23 HD12 ' A' ' 611' ' ' ILE . 18.6 tt -156.32 144.52 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.011 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.573 ' HG1' ' HB3' ' A' ' 570' ' ' ALA . 1.9 m -120.74 127.6 52.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.074 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.431 ' HA ' HD22 ' A' ' 578' ' ' LEU . 45.2 mt -119.75 136.16 54.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.8 t -126.29 139.06 53.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.316 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.539 ' HB3' HD11 ' A' ' 566' ' ' LEU . 41.8 p90 -150.62 169.69 20.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.852 0.358 . . . . 0.0 111.378 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 16.6 m -79.93 131.31 35.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.154 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.23 178.67 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.474 ' H ' ' HH ' ' A' ' 592' ' ' TYR . 0.8 OUTLIER -84.63 169.87 13.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 1.4 p -99.2 -15.54 18.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.722 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.04 61.28 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.017 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -73.83 1.53 10.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.005 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.75 -12.47 12.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.325 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -133.98 -18.92 0.93 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.594 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 5.3 t -72.79 147.51 9.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.851 0.358 . . . . 0.0 111.105 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.5 p -117.91 -49.65 2.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.197 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.553 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -150.1 171.78 30.03 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.783 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.474 ' HH ' ' H ' ' A' ' 583' ' ' SER . 52.6 m-85 -118.61 133.42 55.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.739 0.304 . . . . 0.0 110.786 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.618 ' HB3' HD23 ' A' ' 600' ' ' LEU . 0.5 OUTLIER -111.35 120.5 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.943 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.437 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.37 138.36 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.811 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.509 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 95.7 m-85 -99.97 154.88 18.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.556 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.412 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 13.6 t30 -128.2 84.59 2.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.256 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 97.13 -71.06 0.75 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.426 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.26 4.36 0.14 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 111.378 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -128.2 172.09 11.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.618 HD23 ' HB3' ' A' ' 593' ' ' ASP . 1.0 OUTLIER -79.97 119.8 23.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.8 179.783 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.412 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -90.56 -105.47 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.011 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.558 HG23 HG13 ' A' ' 611' ' ' ILE . 14.4 t -90.5 162.27 15.12 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 111.238 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -127.69 128.83 46.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.427 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.0 m -134.45 -176.35 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.375 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.553 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 73.1 p -140.88 -15.42 0.9 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -91.46 -121.29 2.59 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.621 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.7 p -127.99 -4.41 5.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.831 0.348 . . . . 0.0 111.317 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.9 168.86 9.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.136 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.427 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -154.27 119.4 5.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.915 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.5 m -107.33 120.21 41.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.409 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.558 HG13 HG23 ' A' ' 602' ' ' THR . 3.3 mp -109.42 131.04 61.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.749 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 87.4 p -111.98 172.09 7.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 62.5 80.58 0.11 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.469 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.1 mt -137.87 179.58 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.856 0.36 . . . . 0.0 110.959 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -124.94 155.23 39.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.905 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 161.84 15.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.317 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 6.2 t70 55.68 43.4 28.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.059 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.37 139.05 35.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.333 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.2 t -86.05 131.24 34.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -129.34 137.39 50.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.282 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.13 119.44 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.379 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -113.55 159.87 19.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 111.901 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.73 137.69 11.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.217 -0.902 . . . . 0.0 109.792 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.594 HG23 HD23 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.94 149.05 6.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.024 0.44 . . . . 0.0 111.569 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.509 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 2.7 mmtp -136.79 152.94 50.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.04 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.45 137.63 50.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.236 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.44 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -108.78 170.08 8.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.61 11.04 16.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.999 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -105.51 -13.52 15.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 98.88 41.34 3.11 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.547 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -135.93 130.4 33.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.5 t -124.7 131.09 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.09 175.21 9.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.929 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -65.26 168.05 7.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.265 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.498 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -79.53 140.15 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.404 ' CB ' HG21 ' A' ' 624' ' ' VAL . 1.2 t -67.66 -179.49 1.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.013 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -65.57 153.75 40.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.667 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.51 142.35 31.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.299 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.545 HG21 HD22 ' A' ' 566' ' ' LEU . 3.7 m -129.91 114.33 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.74 123.52 34.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.34 119.48 55.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.181 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -92.01 101.34 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.194 -0.907 . . . . 0.0 111.104 -179.872 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.551 0.215 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.436 ' HB2' ' H ' ' A' ' 561' ' ' THR . 49.2 Cg_endo -68.17 -152.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.533 2.155 . . . . 0.0 112.445 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.737 ' HB ' ' HB3' ' A' ' 583' ' ' SER . 5.7 m -111.53 131.31 55.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.012 0.434 . . . . 0.0 111.396 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.479 ' HB2' ' N ' ' A' ' 635' ' ' ALA . . . -59.58 130.68 88.04 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.383 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.54 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -45.69 146.13 3.94 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.74 2.293 . . . . 0.0 111.819 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.3 p -119.95 137.13 54.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.992 0.425 . . . . 0.0 112.005 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 54.79 94.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.035 179.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.806 HD13 ' HG ' ' A' ' 578' ' ' LEU . 54.6 tp -89.8 160.36 16.55 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.547 ' H ' HD11 ' A' ' 566' ' ' LEU . . . -160.75 178.74 9.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.422 . . . . 0.0 111.684 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.37 149.4 36.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.421 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 5.4 p -124.83 -84.82 0.64 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.602 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.48 112.5 20.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.433 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.58 ' HB2' HG13 ' A' ' 576' ' ' ILE . 3.4 tt0 -134.9 114.02 12.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.904 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 23.8 p -104.07 -165.78 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.82 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -91.17 29.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 11.3 p -162.33 -39.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.021 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.19 171.77 8.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.958 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.5 tt -159.48 151.19 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.419 . . . . 0.0 111.164 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.3 m -119.43 133.69 55.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.793 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.806 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -121.79 131.39 54.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.027 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.83 127.96 46.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.525 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . . . . . . . . . 45.6 p90 -137.29 170.05 16.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.5 m -84.79 134.59 34.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.028 0.442 . . . . 0.0 111.344 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.55 168.63 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.009 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.737 ' HB3' ' HB ' ' A' ' 561' ' ' THR . 1.2 m -79.75 162.52 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.795 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.72 -7.15 58.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.793 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -125.16 64.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.06 0.92 16.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.71 -9.54 13.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.105 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -130.86 -21.22 1.12 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.405 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.418 HG12 ' N ' ' A' ' 590' ' ' THR . 22.9 t -70.43 141.81 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.418 ' N ' HG12 ' A' ' 589' ' ' VAL . 7.1 t -126.14 -11.43 6.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.111 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -178.03 -177.57 46.88 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.715 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.455 ' HH ' ' H ' ' A' ' 583' ' ' SER . 88.6 m-85 -134.02 157.94 44.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.935 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -120.41 129.66 54.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.463 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.593 ' HB ' HG21 ' A' ' 602' ' ' THR . 56.8 t -99.61 140.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.231 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.487 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 92.0 m-85 -123.64 147.93 46.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.419 ' HA ' ' O ' ' A' ' 621' ' ' THR . 25.1 t30 -137.95 88.91 2.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 76.29 59.26 3.39 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.093 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 43.4 p 50.46 44.46 26.94 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.891 0.377 . . . . 0.0 111.261 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.04 121.0 4.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.381 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.44 HD21 ' O ' ' A' ' 594' ' ' VAL . 1.0 OUTLIER -54.97 130.73 42.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.872 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.432 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -112.93 -98.65 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.349 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.593 HG21 ' HB ' ' A' ' 594' ' ' VAL . 14.7 t -90.61 171.6 9.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.117 0.484 . . . . 0.0 111.821 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.484 ' H ' ' HG1' ' A' ' 602' ' ' THR . 2.8 m -137.58 127.8 26.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.46 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.432 HG13 ' O ' ' A' ' 608' ' ' THR . 15.5 m -130.59 -178.22 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.906 0.384 . . . . 0.0 111.542 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.579 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 1.4 p -133.21 -24.93 1.81 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.168 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -85.64 -126.25 1.71 Allowed Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.467 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.44 7.93 6.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.827 0.346 . . . . 0.0 111.039 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -129.2 152.83 48.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.971 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -126.9 155.7 42.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.02 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 89.0 m -134.73 109.11 8.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.997 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.441 HG13 HG22 ' A' ' 602' ' ' THR . 3.3 mp -110.52 116.12 51.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.002 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.71 -174.44 2.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.862 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.27 47.65 77.99 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.635 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.2 mt -117.73 173.84 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.881 0.372 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -135.76 169.87 16.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -84.62 171.11 12.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.364 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 55.7 42.42 29.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.814 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.22 143.19 42.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.285 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 619' ' ' SER . . . . . 0.435 ' HA ' ' HG3' ' A' ' 643' ' ' LYS . 0.1 OUTLIER -98.61 132.21 44.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.218 179.349 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -126.62 125.9 42.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.437 . . . . 0.0 111.911 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 596' ' ' ASN . 1.8 p -110.22 107.71 17.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.643 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 623' ' ' THR . 39.1 m-85 -100.15 156.33 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.523 0.677 . . . . 0.0 112.729 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 622' ' ' PHE . 0.9 OUTLIER -159.22 122.13 3.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.306 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.486 ' CG2' HD12 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.17 157.45 3.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 0.0 111.739 -179.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 635' ' ' ALA . 0.2 OUTLIER -139.98 155.06 47.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.341 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.451 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -104.51 132.14 51.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.793 0.33 . . . . 0.0 110.945 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 632' ' ' ASN . 4.3 pttm -120.81 159.83 24.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.96 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 630' ' ' ALA . 0.4 OUTLIER -112.97 177.85 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -76.64 -19.8 57.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.648 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . 0.402 ' H ' ' CG ' ' A' ' 628' ' ' ASP . . . -100.62 31.64 3.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.52 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 56.42 81.38 0.07 OUTLIER Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.726 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.449 ' O ' ' HA ' ' A' ' 627' ' ' LYS . 1.9 t-20 -160.38 126.64 4.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 0.0 110.716 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 6.5 m -121.89 143.91 32.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.96 0.41 . . . . 0.0 111.711 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.465 ' O ' ' HE2' ' A' ' 625' ' ' LYS . 0.9 OUTLIER -82.78 -145.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.075 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.479 ' N ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.68 177.19 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 110.998 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.51 138.15 31.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.945 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.54 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 12.8 p -67.57 -169.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.855 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -63.36 177.68 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -106.2 121.31 43.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 t -112.03 115.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.684 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 11.1 t -102.47 102.45 12.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.966 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.64 114.77 48.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.928 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.435 ' HG3' ' HA ' ' A' ' 619' ' ' SER . 0.0 OUTLIER -96.86 122.07 39.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.123 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.159 179.768 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.633 0.254 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.74 -179.2 3.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.683 2.255 . . . . 0.0 112.459 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.05 136.66 34.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.24 129.4 94.04 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.5 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.45 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.82 140.08 10.14 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.69 2.26 . . . . 0.0 112.201 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.6 t -122.96 153.64 39.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.907 0.384 . . . . 0.0 111.727 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.94 62.55 1.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.787 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.784 HD13 ' HG ' ' A' ' 578' ' ' LEU . 55.3 tp -82.4 158.93 23.12 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.452 ' H ' HD11 ' A' ' 566' ' ' LEU . . . -161.28 176.03 11.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.996 0.426 . . . . 0.0 111.786 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 20.6 p -130.24 122.62 28.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.233 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.8 p -99.83 -86.8 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.69 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.02 96.76 10.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.252 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.81 102.45 9.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 80.9 p -94.69 -155.43 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.18 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.428 ' HB ' ' HB3' ' A' ' 616' ' ' ALA . 4.9 p -90.16 3.36 53.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.473 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 3.4 p -152.49 -49.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.66 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -99.96 122.28 42.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.794 0.33 . . . . 0.0 111.408 -179.536 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.512 HG21 HD21 ' A' ' 614' ' ' LEU . 14.5 tt -115.49 150.22 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 18.6 m -120.27 119.33 32.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.756 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.784 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -105.85 136.41 45.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.938 -179.617 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.8 122.69 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.49 ' HB3' ' CD1' ' A' ' 566' ' ' LEU . 40.4 p90 -138.45 169.59 17.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.029 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 m -85.27 147.32 26.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.216 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.42 168.19 7.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.339 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.414 ' HB3' ' HH ' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -78.14 -2.15 36.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.885 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 21.45 11.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.168 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.482 ' O ' HG21 ' A' ' 589' ' ' VAL . 25.2 m-20 -153.12 75.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.018 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -87.68 33.86 0.71 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.977 0.418 . . . . 0.0 110.829 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -85.56 -1.25 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.986 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -159.99 -25.84 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 13.6 t -59.03 146.81 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 111.258 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.453 ' N ' HG12 ' A' ' 589' ' ' VAL . 1.7 p -120.05 -40.0 2.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.974 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.588 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -159.53 177.29 36.11 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.394 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.416 ' O ' HG22 ' A' ' 604' ' ' VAL . 94.8 m-85 -123.09 120.12 32.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.812 0.339 . . . . 0.0 111.016 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.458 ' OD1' HG23 ' A' ' 603' ' ' THR . 4.7 m-20 -99.81 120.96 40.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.553 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -100.69 140.36 19.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 0.0 110.861 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.4 ' CE1' ' HG3' ' A' ' 625' ' ' LYS . 85.0 m-85 -99.21 170.71 8.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.004 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -140.26 86.35 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.608 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 83.95 -68.34 3.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.257 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.4 p -151.28 -12.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 140.79 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.922 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.434 HD13 ' HB3' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -55.24 149.11 13.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.423 ' HB3' ' H ' ' A' ' 602' ' ' THR . . . -114.63 -107.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.011 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.423 ' H ' ' HB3' ' A' ' 601' ' ' ALA . 5.0 t -90.73 168.93 11.38 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.155 0.502 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.458 HG23 ' OD1' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -132.37 121.26 23.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.543 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.451 HG13 ' HA ' ' A' ' 609' ' ' ALA . 31.5 m -125.64 -171.71 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.507 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.588 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.3 p -140.2 -12.41 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.145 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.11 -139.09 10.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.451 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 68.3 p -111.93 11.98 20.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 0.0 111.035 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -132.82 154.25 50.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.967 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.451 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -136.43 136.56 39.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.6 113.18 20.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.869 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.484 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.3 mt -107.26 144.09 16.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.55 -166.13 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 59.19 -108.56 1.67 Allowed Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.064 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.512 HD21 HG21 ' A' ' 576' ' ' ILE . 0.3 OUTLIER 56.89 104.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.958 179.109 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -70.01 111.69 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.634 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.428 ' HB3' ' HB ' ' A' ' 573' ' ' THR . . . -56.35 164.9 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.479 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 59.6 27.64 16.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.06 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.4 m -141.07 138.28 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.7 p -80.75 146.48 30.99 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.632 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -140.41 147.86 40.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.939 0.4 . . . . 0.0 111.56 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.567 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.49 120.29 39.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.06 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -109.2 163.01 13.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.32 0.581 . . . . 0.0 112.213 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 637' ' ' SER . 0.8 OUTLIER -155.09 142.92 19.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.604 179.301 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.502 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -107.94 142.5 20.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.076 0.465 . . . . 0.0 111.633 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.4 ' HG3' ' CE1' ' A' ' 595' ' ' TYR . 7.1 mmtt -132.42 143.34 49.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.898 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.446 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -103.87 138.47 40.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' A' ' 633' ' ' VAL . 0.2 OUTLIER -128.55 137.0 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.502 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 0.0 OUTLIER -101.42 168.03 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.981 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.84 51.84 2.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.107 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -152.53 -25.43 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.21 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 116.58 28.66 2.47 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.302 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -121.9 124.63 44.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 0.0 110.682 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.41 HG11 ' HB3' ' A' ' 627' ' ' LYS . 9.4 m -120.83 135.82 59.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.375 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.446 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 10.2 p -69.85 -167.52 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.26 164.04 14.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -74.86 126.58 31.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.443 ' OG ' HG21 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.92 -177.12 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.624 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.11 157.67 9.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.567 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -90.35 131.17 36.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.414 HG11 ' HG ' ' A' ' 566' ' ' LEU . 3.1 m -114.04 109.71 29.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.6 119.77 27.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 12.1 m -123.88 160.28 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.222 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.68 112.18 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 62.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.168 -179.967 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.578 0.228 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.56 -159.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.569 2.18 . . . . 0.0 112.276 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.435 ' O ' ' HB2' ' A' ' 583' ' ' SER . 4.5 p -112.59 123.63 50.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -59.11 132.22 87.37 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.699 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 626' ' ' ALA . 78.5 Cg_exo -49.98 176.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.101 2.534 . . . . 0.0 112.413 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 5.1 t -155.66 148.92 24.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 111.605 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 56.77 68.01 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.653 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.683 HD11 ' HG ' ' A' ' 578' ' ' LEU . 49.4 tp -76.78 159.8 29.82 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.475 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.76 179.95 8.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.945 0.402 . . . . 0.0 111.567 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 82.3 p -142.67 130.21 21.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.463 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.7 p -100.6 -82.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.404 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.479 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -86.12 97.08 10.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.25 97.19 7.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.6 p -84.14 -150.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.956 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 36.4 p -96.12 -45.24 6.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.73 0.3 . . . . 0.0 111.575 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 91.6 p -107.71 -3.68 18.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.625 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.467 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -139.69 163.7 31.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 111.135 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . . . . . . . . . 19.5 tt -155.06 149.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.314 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.479 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.2 m -110.7 125.45 53.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.803 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.683 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.6 OUTLIER -108.94 149.26 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.245 -179.566 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.5 t -144.64 135.05 24.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.256 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.484 ' CD2' HG12 ' A' ' 624' ' ' VAL . 42.0 p90 -152.67 169.87 21.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.969 0.414 . . . . 0.0 111.36 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.6 110.61 16.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.781 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . 0.442 ' HB2' ' HH ' ' A' ' 592' ' ' TYR . . . -51.18 151.32 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.304 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.452 ' H ' ' HH ' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -54.44 136.26 44.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.904 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 4.1 m -62.6 -23.63 67.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.858 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.04 46.46 1.01 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.485 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -65.04 -9.62 23.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.1 m -75.04 3.02 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.897 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -142.42 -2.9 1.06 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.427 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 44.7 t -96.22 146.84 6.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.797 0.332 . . . . 0.0 110.967 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.428 HG22 ' N ' ' A' ' 591' ' ' GLY . 8.1 t -111.2 -31.53 7.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.632 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -164.44 -179.9 38.84 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.878 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.452 ' HH ' ' H ' ' A' ' 583' ' ' SER . 82.1 m-85 -133.41 135.52 44.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.69 121.23 43.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.356 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.55 140.78 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.947 0.404 . . . . 0.0 111.206 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -98.97 166.16 11.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.978 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -140.24 86.94 2.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 71.49 60.79 4.18 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.009 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.7 p 55.37 37.45 28.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.92 0.39 . . . . 0.0 111.487 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.65 112.25 2.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 600' ' ' LEU . 1.1 tm? -45.88 131.17 9.58 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.353 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.486 ' HB1' ' H ' ' A' ' 602' ' ' THR . . . -113.08 -96.89 0.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.353 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.486 ' H ' ' HB1' ' A' ' 601' ' ' ALA . 6.2 t -90.6 168.29 11.91 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.186 0.517 . . . . 0.0 111.985 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 18.2 m -132.5 141.6 48.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.575 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.411 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 3.5 m -140.35 -177.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.431 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.436 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 36.4 p -140.25 -13.27 1.04 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.932 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -98.1 -124.88 5.09 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.61 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.13 -14.67 8.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.3 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -101.24 176.64 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.46 ' HB2' ' HZ3' ' A' ' 580' ' ' TRP . . . -158.78 123.57 4.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.138 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.6 m -105.42 117.27 33.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.235 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.7 mt -106.8 125.34 62.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.75 173.35 6.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . 0.453 ' O ' HD12 ' A' ' 614' ' ' LEU . . . 65.02 67.62 1.96 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.551 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.453 HD12 ' O ' ' A' ' 613' ' ' GLY . 1.2 mp -130.59 153.5 48.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.966 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -121.45 141.45 50.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.158 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.93 174.31 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.68 28.72 14.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.2 m -139.16 141.42 38.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.99 137.38 32.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.587 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -132.62 133.19 43.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.391 . . . . 0.0 111.409 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -113.92 111.44 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.285 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -102.11 165.36 11.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.215 0.531 . . . . 0.0 111.913 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.47 HG21 ' HA ' ' A' ' 639' ' ' ALA . 0.6 OUTLIER -160.22 150.26 18.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.75 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.518 HG22 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -110.49 145.71 16.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.174 0.511 . . . . 0.0 111.777 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.488 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 1.1 mmtp -134.37 127.58 31.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.775 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.478 ' HB3' ' HD3' ' A' ' 563' ' ' PRO . . . -81.71 142.91 32.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.166 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.59 145.15 38.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -107.13 -177.51 3.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -86.23 -9.2 56.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -87.66 -6.0 58.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.129 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 91.09 23.34 30.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -108.27 148.09 30.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.686 0.279 . . . . 0.0 110.698 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 16.7 m -137.66 146.34 27.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.907 0.384 . . . . 0.0 111.43 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.85 -166.05 1.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.556 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.43 169.88 16.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.806 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.488 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.09 135.62 36.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.72 -175.27 0.66 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.426 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 142.62 57.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.695 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 623' ' ' THR . . . -81.72 123.11 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 621' ' ' THR . 9.6 p -99.66 144.46 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.734 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.9 t -118.89 109.74 16.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.87 134.2 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.34 115.93 28.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.723 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.9 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.005 179.975 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.5 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.573 0.225 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.45 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.428 2.085 . . . . 0.0 112.25 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.534 HG22 ' H ' ' A' ' 584' ' ' THR . 0.1 OUTLIER -103.77 130.41 51.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.968 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.27 126.9 92.51 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.438 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.6 Cg_exo -47.5 148.15 5.69 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.556 2.171 . . . . 0.0 112.094 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 30.6 p -138.58 161.11 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 111.387 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.1 51.85 8.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.609 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.596 HD12 ' HB3' ' A' ' 580' ' ' TRP . 11.5 tp -73.89 158.61 34.15 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.567 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -177.64 6.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 111.531 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 86.8 p -138.97 125.72 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.368 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.1 p -99.8 -86.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.509 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.19 102.78 15.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.195 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.494 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.7 OUTLIER -121.25 116.86 25.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.957 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.5 p -98.56 -159.15 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.195 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.534 HG23 ' HB3' ' A' ' 616' ' ' ALA . 0.9 OUTLIER -89.75 2.43 54.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.536 -179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 98.3 p -142.39 -47.99 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.803 0.335 . . . . 0.0 111.195 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 1.0 OUTLIER -100.08 166.37 11.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.82 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.494 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.3 tt -154.91 142.58 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 7.0 m -109.21 113.55 26.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.78 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 608' ' ' THR . 1.0 OUTLIER -102.86 134.06 46.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.203 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 t -128.64 133.97 48.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.596 ' HB3' HD12 ' A' ' 566' ' ' LEU . 42.9 p90 -146.94 169.76 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.171 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -79.98 132.4 36.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.262 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.15 159.8 28.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.094 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.2 p -74.78 158.73 32.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.79 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' THR . . . . . 0.534 ' H ' HG22 ' A' ' 561' ' ' THR . 0.1 OUTLIER -69.86 -17.87 63.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.265 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -103.42 161.73 13.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -160.96 -10.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -6.34 8.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.746 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.33 -35.44 0.37 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.506 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.416 HG11 ' N ' ' A' ' 590' ' ' THR . 4.7 t -59.07 148.45 6.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.416 ' N ' HG11 ' A' ' 589' ' ' VAL . 0.2 OUTLIER -133.5 -19.27 2.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.369 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.543 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.73 173.42 46.05 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.806 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -127.84 130.4 48.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.683 0.278 . . . . 0.0 110.836 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.84 126.26 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.614 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.43 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -100.48 137.19 28.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.01 0.433 . . . . 0.0 111.625 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.732 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 98.0 m-85 -102.36 157.61 16.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.87 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -140.4 100.19 3.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.625 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 58.18 68.56 1.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.202 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.2 p 48.12 33.26 3.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.424 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.47 105.7 1.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.768 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.732 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.5 OUTLIER -47.92 137.7 9.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.386 -179.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.452 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -107.28 -98.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.9 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.452 ' H ' ' HB2' ' A' ' 601' ' ' ALA . 4.0 t -90.64 168.39 11.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.185 0.517 . . . . 0.0 111.741 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 5.1 m -133.19 134.58 44.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.302 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 10.9 m -134.54 -179.75 3.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.496 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.543 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 40.5 p -132.29 -5.94 3.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.31 -131.04 6.9 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.471 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.09 4.69 10.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 111.063 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -128.63 140.1 51.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.9 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.444 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -119.79 157.77 27.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.164 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.75 102.46 5.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.962 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.419 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.2 mt -99.64 121.03 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.98 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.8 t -110.91 174.75 5.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.45 62.28 4.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.466 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 7.9 mt -130.74 143.14 50.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.24 142.92 35.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.043 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.534 ' HB3' HG23 ' A' ' 573' ' ' THR . . . -76.99 159.22 30.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.285 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 11.5 t0 55.48 49.68 16.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.065 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.3 m -139.96 144.55 37.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 619' ' ' SER . . . . . 0.499 ' HA ' ' HG2' ' A' ' 643' ' ' LYS . 13.6 t -85.12 112.77 20.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.518 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.3 m-85 -115.83 134.54 54.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.954 0.406 . . . . 0.0 111.607 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.3 OUTLIER -111.31 125.34 53.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.235 179.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.417 ' H ' HG13 ' A' ' 640' ' ' VAL . 73.2 m-85 -118.96 162.09 19.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.27 0.557 . . . . 0.0 111.935 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.493 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.03 138.56 10.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.861 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.43 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -100.78 151.6 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.065 0.46 . . . . 0.0 111.691 -179.576 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.437 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.6 mmtp -136.77 143.19 43.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.945 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -101.7 143.24 31.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.428 ' HZ2' ' HG2' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -139.0 149.71 45.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.708 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.27 174.89 5.65 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.15 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.37 45.48 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.373 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -151.34 -17.47 0.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.957 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 105.44 36.5 2.84 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.343 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.5 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 87.5 m-20 -119.15 109.56 16.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.762 0.315 . . . . 0.0 110.827 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 25.5 m -109.08 131.25 60.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.296 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -168.63 0.72 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.659 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -72.91 173.22 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.834 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.422 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -88.46 136.46 32.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.856 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.426 ' CB ' HG22 ' A' ' 624' ' ' VAL . 4.8 t -63.98 -174.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.273 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 143.71 48.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.686 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.493 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.68 127.59 32.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.281 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.448 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.4 p -104.39 116.25 47.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.93 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.45 81.39 6.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.557 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 642' ' ' VAL . 11.0 p -103.78 139.69 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.172 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.499 ' HG2' ' HA ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -111.54 155.53 23.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.654 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.246 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.538 0.209 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.452 ' HB2' ' H ' ' A' ' 561' ' ' THR . 59.2 Cg_endo -70.91 -144.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.663 2.242 . . . . 0.0 112.168 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.692 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -117.0 121.23 40.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -63.42 130.12 94.06 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.142 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.463 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.2 Cg_exo -48.95 170.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.808 2.339 . . . . 0.0 112.341 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 4.6 t -158.49 159.13 35.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.252 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 55.88 59.68 3.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.492 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.855 HD13 ' HG ' ' A' ' 578' ' ' LEU . 2.1 tp -85.58 155.51 21.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.642 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.74 175.52 12.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.322 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 18.8 p -123.72 134.23 53.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.6 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.99 -86.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.275 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.711 ' HB2' ' HG1' ' A' ' 577' ' ' THR . . . -90.66 98.58 11.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.512 ' NE2' ' HB ' ' A' ' 642' ' ' VAL . 11.1 tt0 -111.36 134.5 52.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 24.1 p -126.18 -162.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 35.5 p -94.0 24.25 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.244 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.411 ' O ' HD13 ' A' ' 614' ' ' LEU . 53.2 p -165.79 -47.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.1 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -114.57 126.82 55.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.186 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.507 HG13 ' HB2' ' A' ' 571' ' ' GLN . 18.1 tt -120.44 144.78 28.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.061 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.711 ' HG1' ' HB2' ' A' ' 570' ' ' ALA . 28.3 m -104.63 133.03 50.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.855 ' HG ' HD13 ' A' ' 566' ' ' LEU . 1.2 tp -121.78 143.86 49.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.02 0.438 . . . . 0.0 111.386 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -139.4 138.59 36.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.396 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.621 ' HB3' HD11 ' A' ' 566' ' ' LEU . 44.4 p90 -153.55 169.67 22.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 111.269 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.49 128.37 33.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.184 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.54 169.64 2.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.692 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 11.3 p -67.9 -13.89 62.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.17 11.86 4.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.279 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -109.9 -65.05 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.634 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 41.1 t30 55.85 21.22 4.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.235 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.31 -25.25 36.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -162.78 2.11 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.405 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.408 HG12 ' N ' ' A' ' 590' ' ' THR . 10.2 t -64.93 146.27 13.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.32 . . . . 0.0 111.016 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.408 ' N ' HG12 ' A' ' 589' ' ' VAL . 20.7 p -115.7 -38.96 3.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.46 176.82 40.97 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.717 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.683 ' HH ' ' H ' ' A' ' 583' ' ' SER . 85.8 m-85 -117.85 149.29 41.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.724 0.297 . . . . 0.0 110.724 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.56 116.28 20.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.876 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.583 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.98 137.52 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -99.44 168.75 9.79 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.087 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -135.15 88.07 2.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.541 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 93.84 -64.13 1.8 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.238 -179.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -152.96 -39.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -90.27 171.15 9.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -75.06 133.12 41.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.437 ' HB3' ' H ' ' A' ' 602' ' ' THR . . . -99.8 -107.44 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.569 HG22 HG13 ' A' ' 611' ' ' ILE . 9.4 t -90.91 168.02 12.0 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.156 0.503 . . . . 0.0 111.554 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 16.6 m -131.49 133.5 45.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.542 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.2 m -137.87 -174.07 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.561 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.463 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.5 p -138.88 -15.87 1.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.045 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.68 -146.96 20.85 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.743 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.7 p -104.65 20.27 18.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 111.194 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 38.6 p -136.49 160.88 37.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.964 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.503 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.32 148.3 42.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.0 106.25 7.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.569 HG13 HG22 ' A' ' 602' ' ' THR . 2.7 mp -99.91 122.86 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.807 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 83.1 p -100.32 172.6 7.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.928 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 75.73 -87.71 0.85 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.373 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 574' ' ' SER . 1.5 mt 47.62 -156.92 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.836 0.351 . . . . 0.0 111.505 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . 0.405 ' H ' ' HB3' ' A' ' 614' ' ' LEU . . . -164.58 134.74 3.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.791 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -81.96 166.11 20.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.496 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.69 35.92 24.67 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.172 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.33 168.53 19.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.215 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.84 120.72 40.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.192 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -122.9 151.0 42.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.098 0.475 . . . . 0.0 111.993 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -124.87 130.2 51.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.756 178.837 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.442 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 84.2 m-85 -114.63 155.75 25.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.419 0.628 . . . . 0.0 112.385 -178.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.7 p -149.14 148.55 29.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.502 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.583 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -116.54 153.87 18.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.983 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 0.5 OUTLIER -140.0 171.64 13.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.664 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.9 125.97 38.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.316 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -116.23 152.09 34.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.998 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -109.68 176.43 5.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.926 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.22 45.95 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.38 -28.44 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.045 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 123.1 6.71 7.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.343 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -96.94 119.9 36.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.6 p -115.9 147.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.91 -159.72 0.4 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.599 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.14 177.07 6.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.901 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.436 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -87.84 150.54 23.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.979 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -171.87 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -64.93 159.77 22.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -100.81 123.76 45.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.22 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.7 p -99.89 123.34 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.03 103.51 15.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.671 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.512 ' HB ' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -107.52 146.32 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.222 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -104.19 108.15 19.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.732 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.138 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.537 0.208 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.99 -153.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.616 2.211 . . . . 0.0 112.314 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.606 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 2.4 m -116.11 136.17 53.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -74.9 128.67 84.77 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.151 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -47.45 154.4 1.64 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.681 2.254 . . . . 0.0 112.211 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.84 153.83 47.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.295 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 57.03 66.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.359 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.724 HD11 ' HG ' ' A' ' 578' ' ' LEU . 36.3 tp -86.93 159.8 18.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.276 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.462 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.44 172.93 15.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 0.0 111.732 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 568' ' ' SER . . . . . 0.485 ' HG ' HG13 ' A' ' 642' ' ' VAL . 0.3 OUTLIER -127.39 135.03 49.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.176 179.43 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.68 -85.86 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.775 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.08 102.88 13.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.863 0.364 . . . . 0.0 111.482 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.88 130.61 55.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 63.6 p -124.32 -156.81 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.297 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.2 p -94.69 22.58 6.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.408 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 86.2 p -164.71 -48.76 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.123 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.68 164.53 11.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.935 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.406 HG22 HD13 ' A' ' 611' ' ' ILE . 12.3 tt -158.29 145.6 8.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.329 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 10.0 m -107.32 136.11 47.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.497 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.724 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -127.63 125.5 40.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.872 0.367 . . . . 0.0 111.313 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 29.2 t -121.67 137.92 54.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.354 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.469 ' HB3' HD13 ' A' ' 566' ' ' LEU . 46.4 p90 -150.5 169.7 20.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.36 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 29.9 m -82.24 139.54 34.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.039 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.52 167.93 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.935 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.606 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 90.6 p -69.83 -3.98 18.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 9.9 p 52.52 24.36 3.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.007 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -124.0 -54.45 1.72 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 45.62 -154.74 0.04 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.825 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.4 t 54.32 19.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.151 0.501 . . . . 0.0 110.595 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -170.74 -28.79 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.801 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.409 HG13 ' H ' ' A' ' 591' ' ' GLY . 15.5 t -80.01 134.8 26.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.529 0.205 . . . . 0.0 110.629 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 31.4 p -124.96 23.96 7.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.74 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 152.16 167.86 15.71 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.247 -0.977 . . . . 0.0 113.182 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.27 127.27 37.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.85 0.357 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.488 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 2.7 m-20 -105.39 116.96 32.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.338 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.712 ' HB ' HG11 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.31 137.37 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.933 0.397 . . . . 0.0 111.268 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.442 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 87.1 m-85 -99.68 169.4 9.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.269 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -133.96 84.53 2.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 91.15 -52.66 3.19 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.224 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -158.53 -50.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.736 0.303 . . . . 0.0 111.225 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.85 173.48 12.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.958 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.404 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.8 OUTLIER -79.33 149.29 31.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.404 ' N ' ' HG ' ' A' ' 600' ' ' LEU . . . -116.34 -104.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.748 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.769 HG23 HG13 ' A' ' 611' ' ' ILE . 9.9 t -90.92 162.65 14.67 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 111.151 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 22.8 m -127.33 117.13 21.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.899 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.46 HG13 ' O ' ' A' ' 608' ' ' THR . 19.8 m -124.22 -173.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.507 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.74 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 25.1 p -140.75 -11.86 1.0 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.056 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.58 -140.84 11.56 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.632 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.93 27.99 9.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.786 0.326 . . . . 0.0 111.317 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 604' ' ' VAL . 0.3 OUTLIER -149.93 153.24 36.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.949 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.445 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -137.49 144.09 42.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.028 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 34.5 m -122.35 110.89 16.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.281 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.769 HG13 HG23 ' A' ' 602' ' ' THR . 2.6 mp -105.24 122.02 58.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.957 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 612' ' ' SER . . . . . 0.43 ' HG ' ' H ' ' A' ' 613' ' ' GLY . 7.7 t -117.68 170.39 8.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . 0.43 ' H ' ' HG ' ' A' ' 612' ' ' SER . . . 76.83 52.62 5.74 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.383 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.6 mt -122.27 161.8 22.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.87 0.367 . . . . 0.0 110.926 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.81 158.77 16.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -85.57 164.72 17.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.254 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 37.9 t0 55.91 42.33 28.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.222 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.5 m -140.54 139.24 35.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.407 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.68 136.43 35.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.237 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -135.73 118.66 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 111.739 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.97 107.4 18.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.906 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -99.52 160.48 14.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.363 0.602 . . . . 0.0 112.035 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.5 p -150.89 152.88 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.835 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.712 HG11 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -113.83 152.87 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 111.482 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.0 mmtt -140.17 148.95 42.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.192 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -107.64 139.18 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.111 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.2 149.68 52.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.989 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -113.73 169.89 8.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.866 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.75 7.81 11.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.151 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -104.15 -11.35 17.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.999 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 100.97 15.04 29.65 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.445 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -97.18 141.21 30.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.429 HG11 ' HZ1' ' A' ' 625' ' ' LYS . 14.3 t -133.78 129.33 54.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.02 -171.59 2.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.41 176.0 10.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.18 134.5 34.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 5.0 t -66.0 -179.46 0.74 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.149 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.481 ' ND2' ' H ' ' A' ' 566' ' ' LEU . 1.9 p30 -59.47 163.2 4.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.704 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -96.37 129.04 43.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.42 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.97 105.64 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 73.5 m -84.56 96.17 9.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.485 HG13 ' HG ' ' A' ' 568' ' ' SER . 1.7 m -113.8 126.56 71.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.984 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -86.63 144.4 27.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.098 179.793 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.502 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 120.597 0.237 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -72.72 -165.55 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.506 2.137 . . . . 0.0 112.336 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.757 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 22.8 m -94.2 136.87 34.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.618 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -74.14 129.63 84.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.117 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.52 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -46.45 146.98 4.51 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.486 2.124 . . . . 0.0 112.053 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.1 154.21 51.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.968 0.413 . . . . 0.0 111.646 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.72 70.38 0.64 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.466 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.64 HD22 ' HB ' ' A' ' 640' ' ' VAL . 23.9 tp -83.63 159.59 21.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.391 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.518 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.95 169.77 21.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.834 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 134.2 52.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.417 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.6 p -109.8 -89.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.533 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.52 99.95 12.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.83 0.347 . . . . 0.0 111.367 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.533 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -122.6 120.85 34.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.8 p -110.18 -160.25 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.989 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 68.1 p -93.07 27.96 2.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.055 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.6 p -165.71 -58.6 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.73 129.57 49.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.93 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.533 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.0 tt -120.76 142.89 34.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.387 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 3.1 m -117.21 126.68 53.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 608' ' ' THR . 87.5 mt -119.85 146.44 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.525 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 144.72 51.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.995 179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.597 ' HB3' HD11 ' A' ' 566' ' ' LEU . 47.8 p90 -154.61 170.18 22.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 111.282 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.52 131.22 34.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.815 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . 0.644 ' HB3' ' HH ' ' A' ' 592' ' ' TYR . . . -64.06 176.66 0.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.405 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.757 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 23.7 p -74.55 147.18 41.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.968 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -10.73 59.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.178 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -91.42 -63.13 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 55.81 29.75 14.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.039 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.55 -24.88 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -163.4 6.53 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.657 HG23 ' HG ' ' A' ' 583' ' ' SER . 13.9 t -63.9 121.56 13.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 111.112 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.3 t -119.48 -29.77 5.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.652 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -139.78 174.77 22.18 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.748 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.644 ' HH ' ' HB3' ' A' ' 582' ' ' ALA . 87.6 m-85 -134.58 162.71 31.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.72 0.295 . . . . 0.0 110.691 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.474 ' HB3' HD12 ' A' ' 600' ' ' LEU . 7.6 m-20 -132.09 119.11 20.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.647 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.69 146.27 9.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.866 0.365 . . . . 0.0 110.988 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 34.5 m-85 -120.17 164.66 15.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.822 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -140.32 87.6 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.627 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 67.63 71.35 0.95 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.153 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.7 p 47.49 39.6 9.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.928 0.394 . . . . 0.0 111.221 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -160.33 102.05 1.39 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.057 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.531 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -49.21 136.3 15.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.154 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.437 ' HB3' ' H ' ' A' ' 602' ' ' THR . . . -111.91 -98.4 0.42 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.306 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.461 ' O ' HG11 ' A' ' 594' ' ' VAL . 6.5 t -90.6 170.68 9.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.305 0.574 . . . . 0.0 111.983 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.8 m -136.54 137.26 40.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.864 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.413 HG22 ' O ' ' A' ' 608' ' ' THR . 2.3 m -132.03 -176.1 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.929 0.395 . . . . 0.0 111.955 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.652 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.7 p -130.61 -6.92 4.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.734 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.78 -147.38 9.71 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.536 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.2 p -100.18 1.99 42.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.694 0.283 . . . . 0.0 111.456 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 11.6 p -114.32 165.58 12.56 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.43 ' HB3' HG12 ' A' ' 594' ' ' VAL . . . -151.03 134.13 15.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.2 m -121.84 122.77 40.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.307 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.8 mp -112.76 128.65 69.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.779 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.0 155.46 20.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.0 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 78.45 58.05 3.21 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.509 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.0 mt -115.01 154.5 28.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -103.43 144.77 30.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.021 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -87.39 164.2 16.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.65 35.27 22.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.87 156.93 47.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.336 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.3 t -95.05 137.53 33.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -139.41 134.73 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 111.269 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 37.4 p -114.21 125.65 54.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.078 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -113.46 155.14 25.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.279 0.562 . . . . 0.0 111.957 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.51 122.58 5.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.827 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.647 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.1 OUTLIER -99.25 157.55 3.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.139 0.495 . . . . 0.0 112.029 -178.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 5.7 mttt -136.85 163.54 30.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.411 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -111.08 133.55 53.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 0.0 111.089 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -126.36 143.84 51.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.958 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 156.26 19.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.51 62.69 6.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -157.89 -39.11 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 134.06 44.15 0.12 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.771 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 63.3 m-80 -141.91 147.95 37.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.728 0.299 . . . . 0.0 110.927 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 633' ' ' VAL . 0.4 OUTLIER -137.36 144.99 30.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.209 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 8.2 p -87.4 -164.69 1.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.752 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.618 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -88.88 177.49 6.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.548 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.531 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.75 141.55 31.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 111.228 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.52 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -72.29 -177.39 2.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.922 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.39 144.18 47.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.689 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.94 112.29 17.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.323 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.64 ' HB ' HD22 ' A' ' 566' ' ' LEU . 1.2 t -100.02 137.13 28.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.591 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.8 m -116.53 109.92 17.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.984 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.8 p -115.37 149.72 17.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.996 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -114.86 128.99 56.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.036 179.816 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.527 0.074 0 CA-C-O 120.684 0.278 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.402 ' HB3' HG23 ' A' ' 589' ' ' VAL . 85.2 Cg_endo -81.28 -157.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.629 2.219 . . . . 0.0 112.418 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.86 150.29 28.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.79 128.06 64.92 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -48.1 153.05 3.0 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.703 2.269 . . . . 0.0 112.146 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.07 160.19 41.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.464 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 59.64 45.36 13.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.248 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.601 HD13 ' HB3' ' A' ' 580' ' ' TRP . 63.9 tp -68.07 158.12 33.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.76 0.314 . . . . 0.0 110.68 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -162.07 -176.74 5.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.321 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 568' ' ' SER . . . . . 0.5 ' HA ' HD23 ' A' ' 578' ' ' LEU . 83.8 p -123.37 156.64 35.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.32 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.49 -89.4 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.727 0.299 . . . . 0.0 111.478 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.04 101.46 13.8 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.19 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.82 99.75 7.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.966 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 19.6 p -95.2 -155.18 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.812 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 14.4 p -96.99 19.59 12.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.51 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.434 ' HG ' ' H ' ' A' ' 575' ' ' SER . 92.8 p -165.93 -46.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.136 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.434 ' H ' ' HG ' ' A' ' 574' ' ' SER . 0.1 OUTLIER -101.78 137.88 39.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.422 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -133.1 141.25 45.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.43 131.84 55.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.011 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.545 ' O ' ' HA ' ' A' ' 608' ' ' THR . 76.2 mt -121.89 134.96 54.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.906 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 5.5 t -118.76 140.61 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.679 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.601 ' HB3' HD13 ' A' ' 566' ' ' LEU . 46.6 p90 -152.67 169.72 22.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.085 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.4 m -84.68 115.23 22.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -50.92 153.35 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.199 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.93 142.42 15.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.764 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 23.2 p -59.84 -15.35 20.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.228 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -112.46 153.91 26.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.034 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.521 ' C ' ' H ' ' A' ' 588' ' ' GLY . 0.3 OUTLIER -153.06 -157.83 0.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.548 179.924 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . 0.464 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 28.2 t 71.29 -22.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.365 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . 0.521 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -124.8 -20.84 2.25 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.088 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.402 HG23 ' HB3' ' A' ' 560' ' ' PRO . 96.4 t -70.13 141.8 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 110.693 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.728 HG22 ' HE3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -102.42 -67.07 0.89 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.8 -179.336 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.589 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -145.38 -176.36 19.27 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.005 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -121.79 127.35 50.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.887 0.375 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.437 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 5.5 m-20 -101.65 118.3 36.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.423 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.73 135.18 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.957 0.408 . . . . 0.0 110.909 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.708 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.0 m-85 -102.59 151.1 22.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.847 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -127.74 93.14 3.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.178 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 50.7 72.93 0.42 Allowed Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.926 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.5 p 50.07 37.41 14.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.075 0.464 . . . . 0.0 110.931 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.9 94.66 1.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.728 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.708 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.3 tt -44.92 129.96 7.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.441 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.428 ' HB1' ' H ' ' A' ' 602' ' ' THR . . . -97.58 -103.05 0.19 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.129 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.428 ' H ' ' HB1' ' A' ' 601' ' ' ALA . 12.5 t -90.65 172.51 8.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.139 0.495 . . . . 0.0 111.683 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 63.1 m -138.32 105.29 5.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.268 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.421 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 25.8 m -105.98 -167.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.576 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.589 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.0 p -142.88 -0.55 1.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.031 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.88 -143.02 7.75 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.655 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 607' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 4.8 p -104.39 6.92 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.086 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -126.22 141.38 51.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.303 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -127.15 117.81 23.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.961 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.19 118.94 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.235 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.422 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -111.86 129.78 66.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.081 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 6.6 p -117.33 142.49 47.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 97.55 64.2 0.89 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.51 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.5 mt -130.86 158.47 40.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -110.64 138.73 46.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.154 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.83 172.37 8.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.177 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 28.4 t0 56.32 34.91 24.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.262 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.21 141.7 35.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.484 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.92 130.09 35.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.617 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -130.78 142.1 50.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.92 0.391 . . . . 0.0 111.501 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 1.3 m -120.4 133.35 55.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.342 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.458 ' O ' HG21 ' A' ' 640' ' ' VAL . 93.5 m-85 -121.88 156.79 32.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 0.0 112.068 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 3.1 p -152.53 131.6 12.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.587 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.422 HG22 HD11 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -98.84 153.43 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.303 0.573 . . . . 0.0 111.804 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.658 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mttt -140.5 143.39 35.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.492 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -103.76 116.52 32.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 0.0 111.741 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.728 ' HE3' HG22 ' A' ' 590' ' ' THR . 0.0 OUTLIER -108.52 149.53 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.537 179.524 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -103.44 160.25 14.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.754 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.41 50.39 1.45 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.424 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . 0.452 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . . . -155.87 -35.19 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.012 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 132.21 39.74 0.22 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.396 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.482 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 1.5 t-20 -136.16 116.57 13.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.7 p -116.44 146.08 21.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.007 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.25 -167.0 1.7 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -77.14 -179.29 5.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.097 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.44 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.19 144.78 25.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.999 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 2.5 p -75.58 -174.89 2.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.917 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -64.9 150.1 48.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.785 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -83.92 128.19 34.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.204 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.458 HG21 ' O ' ' A' ' 622' ' ' PHE . 2.7 m -111.78 105.39 18.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.991 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.2 91.44 8.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.973 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -99.61 171.61 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -143.5 128.8 18.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.839 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.139 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.452 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 561' ' ' THR . 73.8 Cg_endo -73.57 -152.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.485 2.123 . . . . 0.0 112.194 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.598 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 17.8 m -113.67 127.75 56.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.119 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.42 131.72 92.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.109 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.429 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.51 159.61 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.883 2.389 . . . . 0.0 112.141 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.4 p -134.49 138.03 44.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.997 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.73 84.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.202 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.599 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 10.6 tp -90.63 159.39 16.44 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.599 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.73 164.46 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.037 0.446 . . . . 0.0 111.805 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 568' ' ' SER . . . . . 0.409 ' HA ' HD11 ' A' ' 578' ' ' LEU . 47.3 p -111.55 138.44 48.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.256 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 569' ' ' THR . . . . . 0.566 ' HG1' HG22 ' A' ' 577' ' ' THR . 0.1 OUTLIER -116.66 -89.88 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.621 ' HB1' ' HG1' ' A' ' 577' ' ' THR . . . -89.71 102.76 15.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 111.461 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.474 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.69 143.49 46.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.69 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.459 ' HB ' ' H ' ' A' ' 573' ' ' THR . 24.6 p -129.92 -159.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.957 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.459 ' H ' ' HB ' ' A' ' 572' ' ' THR . 42.9 p -89.65 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.658 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.8 p -142.04 -50.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.791 0.329 . . . . 0.0 111.212 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -101.58 167.25 10.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.85 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.474 HG13 ' HB2' ' A' ' 571' ' ' GLN . 15.1 tt -155.92 147.42 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.621 ' HG1' ' HB1' ' A' ' 570' ' ' ALA . 20.8 m -110.02 142.34 41.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.805 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.565 ' HG ' HD12 ' A' ' 566' ' ' LEU . 0.8 OUTLIER -132.89 133.4 43.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -127.55 139.95 52.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.592 ' HB3' HD13 ' A' ' 566' ' ' LEU . 45.0 p90 -154.39 169.68 23.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.3 m -81.5 138.15 35.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.335 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . 0.414 ' HB2' ' HH ' ' A' ' 592' ' ' TYR . . . -69.39 171.84 8.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.223 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.598 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.9 OUTLIER -73.35 179.12 4.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.774 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -11.07 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.323 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -77.79 -63.98 1.26 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.051 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.8 m120 56.67 -161.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.774 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t 52.95 25.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.128 0.489 . . . . 0.0 110.655 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.97 -30.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.991 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 33.5 t -66.83 138.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.709 0.29 . . . . 0.0 110.508 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.55 -65.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.629 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.497 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -136.42 -164.79 10.33 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.31 -0.947 . . . . 0.0 113.251 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.415 ' HB2' ' HZ2' ' A' ' 580' ' ' TRP . 95.3 m-85 -135.25 138.86 43.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.738 0.304 . . . . 0.0 111.009 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.14 119.22 38.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.414 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.517 HG13 HG22 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.2 137.78 25.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.445 ' HB2' ' HG1' ' A' ' 623' ' ' THR . 30.5 m-85 -104.13 147.76 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.726 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -109.05 84.15 1.87 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.323 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.5 -77.78 1.98 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -142.56 12.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.995 0.426 . . . . 0.0 111.138 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -132.69 174.51 10.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.382 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.95 133.91 34.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.77 0.319 . . . . 0.0 110.516 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.21 -108.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.692 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.582 ' HG1' ' H ' ' A' ' 603' ' ' THR . 3.4 t -91.79 171.83 8.88 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.303 0.573 . . . . 0.0 111.813 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.582 ' H ' ' HG1' ' A' ' 602' ' ' THR . 0.2 OUTLIER -133.6 124.66 27.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.913 179.467 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.588 HG12 ' HA ' ' A' ' 609' ' ' ALA . 10.6 m -121.67 175.02 5.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.928 0.394 . . . . 0.0 112.027 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.497 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -132.56 -14.87 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.942 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -95.94 -108.98 2.42 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.597 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.72 -29.49 1.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.569 0.223 . . . . 0.0 111.489 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.525 ' O ' HG12 ' A' ' 604' ' ' VAL . 2.4 p -88.32 -177.04 5.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.188 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.588 ' HA ' HG12 ' A' ' 604' ' ' VAL . . . -160.68 133.04 6.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.977 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.2 m -119.01 110.35 17.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.072 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.552 HG13 HG23 ' A' ' 602' ' ' THR . 2.8 mp -103.48 124.34 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.825 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 70.3 m -109.06 168.09 9.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 79.89 52.21 4.76 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.666 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 17.2 mt -118.13 165.75 13.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -127.44 131.93 50.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.539 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -68.53 176.32 2.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.285 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 59.43 22.25 10.72 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.44 151.32 44.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.364 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 67.6 m -92.37 146.1 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.325 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -139.6 128.88 23.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.91 0.385 . . . . 0.0 111.702 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.03 134.99 46.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.835 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -128.65 163.42 25.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.373 0.606 . . . . 0.0 112.159 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.445 ' HG1' ' HB2' ' A' ' 595' ' ' TYR . 1.1 p -147.54 164.8 32.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.83 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.45 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -135.01 142.46 40.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 111.548 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.551 ' HD2' HG23 ' A' ' 633' ' ' VAL . 7.7 mttt -131.25 162.87 29.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.737 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.9 132.46 55.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.179 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -123.65 154.6 39.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.45 -179.91 3.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.894 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.95 -3.41 57.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -100.21 -0.09 39.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.025 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.27 35.25 15.12 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.652 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.452 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.5 m-80 -116.32 132.92 56.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 0.0 110.919 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.551 HG23 ' HD2' ' A' ' 625' ' ' LYS . 2.8 p -120.2 147.19 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.094 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.41 -152.05 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.579 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.35 174.15 7.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.967 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.477 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.13 130.74 36.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.124 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -178.71 1.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.017 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.76 150.48 36.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.749 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -90.07 125.08 35.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.39 150.63 6.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.774 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.83 125.97 54.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 6.4 p -127.4 134.99 64.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.934 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.1 111.84 24.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.934 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.539 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 22.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.15 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 120.654 0.264 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.423 ' HB3' HG21 ' A' ' 589' ' ' VAL . 57.2 Cg_endo -70.68 -152.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.508 2.138 . . . . 0.0 112.134 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.9 OUTLIER -116.55 125.72 52.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.927 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.428 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -59.19 124.22 73.54 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.942 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.47 144.52 7.11 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.466 2.111 . . . . 0.0 112.105 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 51.2 p -132.66 155.44 48.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.401 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t30 58.76 64.46 1.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.447 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.808 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.0 tp -88.3 156.71 19.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.233 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.65 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.13 172.38 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.961 0.41 . . . . 0.0 111.589 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 40.1 p -118.18 128.96 55.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.354 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 569' ' ' THR . . . . . 0.617 ' HG1' ' HB ' ' A' ' 577' ' ' THR . 2.9 p -99.87 -87.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.521 -179.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.569 ' H ' ' HG1' ' A' ' 569' ' ' THR . . . -89.44 96.66 10.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 111.438 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.635 HE21 HG21 ' A' ' 644' ' ' THR . 1.9 tt0 -112.26 136.32 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.771 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.7 p -130.66 -162.14 1.19 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.096 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.4 p -91.86 6.66 45.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.451 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -135.95 -56.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.24 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.561 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 10.9 t -113.91 158.45 21.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.513 HD13 ' HG3' ' A' ' 571' ' ' GLN . 15.4 tt -142.0 136.33 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.617 ' HB ' ' HG1' ' A' ' 569' ' ' THR . 1.7 m -99.72 129.55 45.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.646 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.808 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -119.08 133.15 55.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.097 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 84.8 p -125.7 146.95 49.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.291 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.65 ' HB3' HD12 ' A' ' 566' ' ' LEU . 49.1 p90 -159.2 170.33 22.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.936 0.398 . . . . 0.0 111.379 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.33 133.18 36.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -71.0 174.66 5.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.07 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 t -83.2 149.37 26.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.877 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 3.9 p -75.43 -7.7 54.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.505 ' O ' HG22 ' A' ' 589' ' ' VAL . 72.9 m-20 -125.25 67.83 1.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.738 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.77 3.91 13.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.96 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.64 -12.22 15.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.047 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.75 -32.14 0.57 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.543 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 585' ' ' ASP . 11.1 t -61.13 150.39 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.733 0.302 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.11 -50.6 1.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.426 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -147.3 175.15 26.81 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.813 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -122.59 157.86 31.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.794 0.33 . . . . 0.0 110.978 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.68 120.88 16.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.53 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -101.25 137.16 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.955 0.407 . . . . 0.0 110.731 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 59.2 m-85 -104.07 147.85 26.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.75 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -99.69 84.29 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.132 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 598' ' ' THR . . . 88.11 -62.26 3.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.125 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 598' ' ' THR . . . . . 0.463 HG21 ' O ' ' A' ' 597' ' ' GLY . 0.9 OUTLIER -153.4 -20.7 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.994 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -96.07 163.63 13.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.915 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -80.05 118.14 21.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.722 0.296 . . . . 0.0 110.465 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -90.09 -106.38 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.939 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.0 t -91.1 167.68 12.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.103 0.477 . . . . 0.0 111.358 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.31 130.02 38.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.214 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.406 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 17.2 m -131.79 -178.8 2.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.581 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 65.6 p -135.67 -17.09 1.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -94.83 -139.08 9.8 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.01 16.92 19.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.291 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -133.89 170.38 15.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.053 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 577' ' ' THR . . . -148.55 140.93 24.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.849 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.435 HG21 ' OG ' ' A' ' 575' ' ' SER . 0.8 OUTLIER -125.95 113.13 16.76 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.476 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -110.39 108.36 25.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.788 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.8 166.8 10.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.967 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 82.48 32.42 27.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.437 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 10.8 mt -92.83 166.95 12.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.857 0.36 . . . . 0.0 111.097 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -116.36 147.08 41.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.744 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -78.18 162.09 26.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.506 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 58.43 38.02 25.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.408 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.48 147.01 38.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.348 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.17 144.04 28.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.55 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -137.86 153.4 49.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 111.767 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.533 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -125.02 139.44 53.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.098 179.169 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.458 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 44.9 m-85 -132.75 152.07 51.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 112.327 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 45.4 p -146.57 128.51 15.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.659 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.581 ' H ' ' HG ' ' A' ' 637' ' ' SER . 0.0 OUTLIER -99.53 147.47 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 1.8 mttt -132.43 169.8 16.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.499 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.487 ' O ' HG23 ' A' ' 633' ' ' VAL . . . -128.08 130.88 48.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.867 0.365 . . . . 0.0 111.379 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -121.02 147.15 45.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.723 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.37 171.93 7.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.06 40.5 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.198 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -139.9 -41.44 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.076 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 142.1 -9.27 2.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.643 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -83.1 137.64 34.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 111.033 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 626' ' ' ALA . 0.8 OUTLIER -129.74 148.61 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.931 179.802 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.99 -164.11 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.428 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -90.08 178.01 6.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.024 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -85.69 149.37 25.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.581 ' HG ' ' H ' ' A' ' 624' ' ' VAL . 0.8 OUTLIER -82.61 -175.8 5.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.896 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -62.2 160.84 12.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.2 131.65 39.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.533 ' O ' ' HA ' ' A' ' 621' ' ' THR . 13.6 p -115.59 134.05 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 8.3 t -104.99 130.24 53.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -117.05 150.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.973 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.64 88.74 2.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.635 HG21 HE21 ' A' ' 571' ' ' GLN . 51.4 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.121 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.49 0.186 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.616 ' HD3' ' HB3' ' A' ' 628' ' ' ASP . 70.0 Cg_endo -73.41 -178.77 3.88 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.442 2.095 . . . . 0.0 112.319 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.61 154.71 36.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.528 ' HB1' ' O ' ' A' ' 635' ' ' ALA . . . -91.86 129.97 40.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.334 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.453 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 77.3 Cg_exo -50.12 151.4 9.1 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.511 2.141 . . . . 0.0 111.749 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 45.5 p -139.19 156.89 46.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 111.693 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.54 54.19 5.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.779 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.722 HD21 HG23 ' A' ' 624' ' ' VAL . 16.5 tp -82.38 156.27 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.682 0.277 . . . . 0.0 110.302 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.531 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.04 179.66 7.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.998 0.428 . . . . 0.0 111.67 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 93.2 p -126.75 123.17 36.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.178 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.6 -87.27 0.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.846 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -79.78 97.9 6.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.7 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -113.33 119.48 37.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.528 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 11.6 p -113.77 -161.02 0.75 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.006 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 30.1 p -91.46 20.55 5.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -167.68 -46.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.736 0.303 . . . . 0.0 111.405 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.5 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -105.77 130.69 53.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.216 -179.682 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . . . . . . . . . 17.1 tt -121.05 147.34 24.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.214 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 31.8 m -111.65 131.38 55.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.698 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.712 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.5 tp -121.66 130.44 53.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 11.1 t -126.76 136.59 52.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.68 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.463 ' CD2' HG12 ' A' ' 624' ' ' VAL . 40.9 p90 -150.98 170.41 19.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.837 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.8 m -79.39 127.35 31.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.7 133.31 55.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.94 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.1 m -72.04 151.92 42.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -177.51 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 54.63 53.4 10.69 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.92 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -65.76 -10.33 36.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.882 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.5 m -66.68 -10.22 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.258 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -125.28 -34.8 0.65 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.552 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 627' ' ' LYS . 2.8 t -65.7 130.27 30.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 111.048 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.01 -23.06 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.181 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -175.9 178.22 47.44 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.65 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -126.03 126.31 44.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.826 0.346 . . . . 0.0 111.014 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.75 118.7 37.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.54 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.81 130.62 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.503 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.5 m-85 -99.67 154.51 18.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.677 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -136.47 90.22 2.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.499 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 70.19 59.55 5.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.148 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.6 p 53.58 40.49 31.49 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.962 0.41 . . . . 0.0 111.393 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.84 111.44 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.907 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -48.6 124.28 8.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.336 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -100.75 -106.39 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.081 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.509 ' HG1' ' H ' ' A' ' 603' ' ' THR . 9.5 t -91.02 167.67 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.139 0.495 . . . . 0.0 111.525 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.509 ' H ' ' HG1' ' A' ' 602' ' ' THR . 6.6 m -131.78 129.02 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.555 HG12 ' HA ' ' A' ' 609' ' ' ALA . 14.9 m -130.32 -170.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.528 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.595 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.9 p -145.65 -26.69 0.46 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.97 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -79.03 -113.42 0.22 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.913 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.4 p -139.14 3.65 2.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.736 0.303 . . . . 0.0 111.241 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 41.1 p -129.46 146.34 51.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.555 ' HA ' HG12 ' A' ' 604' ' ' VAL . . . -124.06 136.02 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.031 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.34 129.47 54.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 575' ' ' SER . 2.7 mp -125.45 119.53 55.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.065 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.99 131.44 55.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.007 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 115.99 60.1 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.625 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.5 mt -129.61 173.89 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.724 0.297 . . . . 0.0 110.698 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -132.3 145.01 50.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.74 173.31 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.172 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 55.34 38.17 29.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 618' ' ' THR . . . . . 0.413 HG22 ' H ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -137.64 161.43 36.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.399 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 619' ' ' SER . . . . . 0.413 ' H ' HG22 ' A' ' 618' ' ' THR . 3.2 m -119.99 127.46 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.591 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -123.89 149.49 45.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.997 0.427 . . . . 0.0 111.215 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 44.5 p -124.3 106.13 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.395 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.457 ' O ' HG21 ' A' ' 640' ' ' VAL . 94.5 m-85 -100.0 157.75 16.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.212 0.53 . . . . 0.0 111.749 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.449 HG21 ' O ' ' A' ' 622' ' ' PHE . 1.5 p -152.38 134.66 15.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.731 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.722 HG23 HD21 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.37 141.1 17.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.277 0.561 . . . . 0.0 111.975 -179.158 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.581 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -130.03 152.21 49.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.551 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.15 144.26 39.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.466 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -122.12 176.71 5.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.543 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.616 ' HB3' ' HD3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -138.45 172.15 13.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.84 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.82 42.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.368 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -150.16 -6.69 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.165 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 93.13 35.52 6.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.444 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -119.17 138.91 52.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 35.5 m -114.65 151.6 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.481 ' OG ' ' HG2' ' A' ' 560' ' ' PRO . 0.7 OUTLIER -90.33 -157.78 0.5 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.394 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.528 ' O ' ' HB1' ' A' ' 562' ' ' ALA . . . -88.76 156.96 18.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.791 0.329 . . . . 0.0 110.652 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.581 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.05 116.01 19.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.821 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.84 173.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.162 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -58.03 147.49 29.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.417 ' HA ' HG21 ' A' ' 623' ' ' THR . . . -80.45 139.92 36.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.076 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.457 HG21 ' O ' ' A' ' 622' ' ' PHE . 2.6 m -116.51 103.57 15.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.968 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 14.5 t -83.6 106.32 15.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.862 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 10.9 p -109.07 145.12 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.441 ' HE2' ' O ' ' A' ' 644' ' ' THR . 0.2 OUTLIER -120.29 111.49 17.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.722 179.73 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.441 ' O ' ' HE2' ' A' ' 643' ' ' LYS . 69.6 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.259 -0.876 . . . . 0.0 111.18 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.447 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.569 0.223 . . . . 0.0 111.018 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.81 -163.97 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.54 2.16 . . . . 0.0 112.343 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 583' ' ' SER . 5.0 m -100.29 124.63 45.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.101 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 635' ' ' ALA . . . -62.97 129.65 93.48 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.467 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 85.0 Cg_exo -45.78 151.89 1.18 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.911 2.407 . . . . 0.0 112.295 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.2 p -136.17 155.49 50.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.9 0.381 . . . . 0.0 111.534 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 59.5 t30 57.23 67.47 0.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.576 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.789 HD11 ' HG ' ' A' ' 578' ' ' LEU . 15.2 tp -86.69 159.31 19.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.0 179.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.573 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.89 167.37 26.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.985 0.421 . . . . 0.0 111.888 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 4.6 p -121.23 146.65 46.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.334 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.1 p -125.98 -86.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.446 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.433 ' O ' ' HA ' ' A' ' 576' ' ' ILE . . . -82.15 97.93 8.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.194 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.98 95.28 4.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -84.45 -154.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.185 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.49 -11.55 39.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.69 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.7 p -136.82 -40.18 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.64 162.45 13.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.176 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 610' ' ' THR . 17.4 tt -156.46 149.32 10.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.862 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 10.4 m -119.04 140.06 50.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.75 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.789 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -124.06 149.65 45.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.86 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 9.7 t -142.74 131.27 22.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.211 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.473 ' CZ2' HG13 ' A' ' 624' ' ' VAL . 43.5 p90 -149.56 169.65 20.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.204 -179.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 m -79.89 143.61 34.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.961 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.44 170.18 0.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.441 ' O ' ' HB ' ' A' ' 561' ' ' THR . 2.2 p -69.87 -5.4 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.53 16.45 5.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -152.49 72.11 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.675 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.472 ' HB2' ' H ' ' A' ' 587' ' ' VAL . 0.2 OUTLIER -70.24 -128.87 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.721 -179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . 0.472 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 4.2 m 44.1 26.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.119 0.485 . . . . 0.0 111.723 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -176.87 -37.62 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.918 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.67 144.4 13.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.564 0.221 . . . . 0.0 110.559 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.3 t -132.43 -30.11 1.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.722 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.49 172.41 30.98 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.011 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -130.93 134.87 47.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.691 0.281 . . . . 0.0 110.647 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -99.99 128.45 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.796 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.609 ' HB ' HG21 ' A' ' 602' ' ' THR . 61.6 t -99.66 132.51 44.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.979 0.419 . . . . 0.0 111.308 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.707 ' HB2' ' HG1' ' A' ' 623' ' ' THR . 52.2 m-85 -101.31 124.66 47.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.928 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.459 ' HB2' ' HB1' ' A' ' 601' ' ' ALA . 47.6 t30 -100.06 84.61 2.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . 0.428 ' O ' HG22 ' A' ' 598' ' ' THR . . . 95.92 -80.8 0.79 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.277 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 598' ' ' THR . . . . . 0.428 HG22 ' O ' ' A' ' 597' ' ' GLY . 4.5 p -147.18 16.98 1.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.783 0.325 . . . . 0.0 111.072 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -145.35 173.05 12.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -71.07 149.93 46.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.825 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.459 ' HB1' ' HB2' ' A' ' 596' ' ' ASN . . . -132.92 -100.94 0.26 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.342 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.609 HG21 ' HB ' ' A' ' 594' ' ' VAL . 14.0 t -90.13 172.65 8.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.916 0.388 . . . . 0.0 111.428 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 80.1 m -140.34 126.07 19.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.858 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.463 HG13 ' HA ' ' A' ' 609' ' ' ALA . 7.0 m -126.36 -177.09 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.528 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.722 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 67.4 p -137.89 -11.34 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.27 -126.52 5.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.464 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 4.4 p -122.72 -4.39 8.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.749 0.309 . . . . 0.0 111.059 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 17.2 p -111.23 173.59 6.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.024 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.463 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -155.45 127.74 7.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.075 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.9 m -114.14 112.91 23.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.157 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.594 HG13 HG22 ' A' ' 602' ' ' THR . 4.9 mp -105.94 131.9 54.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.937 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 15.9 p -120.89 173.73 7.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.106 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 74.8 44.47 24.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.727 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.3 mt -117.7 132.52 56.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.818 0.342 . . . . 0.0 110.825 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.02 143.88 35.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.59 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -74.96 167.38 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.133 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.21 35.06 25.72 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.8 m -137.51 146.43 44.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.232 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.83 136.88 32.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -135.76 140.36 44.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 111.615 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 2.0 p -111.97 135.02 53.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.532 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.636 ' H ' HG11 ' A' ' 640' ' ' VAL . 54.5 m-85 -126.45 161.27 28.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.279 0.562 . . . . 0.0 112.396 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.707 ' HG1' ' HB2' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -160.26 159.11 31.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.768 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.473 HG13 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -124.14 152.61 29.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.047 0.451 . . . . 0.0 111.497 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 3.8 mttt -139.15 139.36 37.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.803 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.495 ' HB2' ' OG ' ' A' ' 634' ' ' SER . . . -94.96 116.42 28.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.0 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -108.71 148.59 30.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.104 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -116.19 169.92 8.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.773 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.64 -13.84 59.62 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.159 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -83.8 5.62 24.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.046 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.03 2.86 90.68 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.404 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.447 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 34.3 m-20 -95.81 123.47 39.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.761 0.315 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.5 p -120.91 136.79 56.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.495 ' OG ' ' HB2' ' A' ' 626' ' ' ALA . 1.9 p -69.03 -167.51 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.952 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.468 ' O ' ' HB3' ' A' ' 562' ' ' ALA . . . -89.3 -178.46 5.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.751 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.522 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.16 146.0 28.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.6 p -82.64 -164.13 0.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.7 146.63 54.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.617 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.416 ' HA ' HG21 ' A' ' 623' ' ' THR . . . -79.69 148.68 31.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.916 0.388 . . . . 0.0 111.163 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.636 HG11 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -114.7 158.46 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.767 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 641' ' ' SER . . . . . 0.407 ' N ' HG12 ' A' ' 640' ' ' VAL . 44.7 t -143.94 105.52 4.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.769 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.87 140.01 48.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.098 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.09 102.02 9.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.672 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.59 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 75.1 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.139 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.529 0.204 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -65.48 -169.06 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.603 2.202 . . . . 0.0 112.396 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.44 ' HG1' ' HB2' ' A' ' 585' ' ' ASP . 0.2 OUTLIER -88.95 118.12 28.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.126 179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.531 ' HB1' ' N ' ' A' ' 635' ' ' ALA . . . -60.17 127.29 85.84 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 88.4 Cg_exo -46.87 156.66 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.701 2.267 . . . . 0.0 112.034 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.52 159.32 40.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.449 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 60.0 49.94 7.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.287 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.795 HD13 ' HG ' ' A' ' 578' ' ' LEU . 56.9 tp -74.07 159.67 32.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.424 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.511 ' H ' HD11 ' A' ' 566' ' ' LEU . . . -161.33 -176.81 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.435 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 35.3 p -133.89 130.59 38.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.332 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.5 p -104.09 -85.29 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.454 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.81 103.56 14.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.05 116.94 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.809 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -108.68 -161.43 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.081 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.54 16.98 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 1.8 p -161.63 -43.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.186 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.7 167.11 10.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.633 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . . . . . . . . . 18.3 tt -160.44 147.31 5.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.907 0.384 . . . . 0.0 111.27 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.4 m -116.55 134.41 54.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.642 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.795 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -118.76 133.94 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.082 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.32 132.98 48.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.431 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.438 ' HB3' HD12 ' A' ' 566' ' ' LEU . 36.8 p90 -148.29 169.74 19.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.175 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 7.2 m -81.32 115.57 20.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.979 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.1 154.24 19.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.329 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 84.0 p -61.28 132.96 55.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.894 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -19.91 61.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.222 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.44 ' HB2' ' HG1' ' A' ' 561' ' ' THR . 1.3 m-20 -89.38 53.58 2.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.479 ' C ' ' H ' ' A' ' 588' ' ' GLY . 42.0 p-10 -72.54 -150.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 71.53 -17.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -132.66 -26.8 0.63 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.88 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 83.4 t -66.87 145.25 13.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.725 0.297 . . . . 0.0 110.81 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.539 HG21 ' HB3' ' A' ' 629' ' ' ALA . 0.7 OUTLIER -99.4 -67.09 0.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.48 -179.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -143.61 -173.06 14.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.931 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -125.84 130.85 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 110.876 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.26 120.75 43.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.662 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.622 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.68 136.16 32.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.906 0.384 . . . . 0.0 110.764 179.988 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -99.35 174.97 6.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.157 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -140.63 84.43 1.95 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.357 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.06 -66.22 3.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.233 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.11 31.76 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.859 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.65 137.06 11.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.068 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.66 136.22 54.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.202 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -109.74 -104.3 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.969 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.613 HG23 HG13 ' A' ' 611' ' ' ILE . 6.7 t -90.44 163.09 14.79 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.079 0.466 . . . . 0.0 111.344 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.5 m -126.95 131.55 51.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.616 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.499 HG11 ' O ' ' A' ' 608' ' ' THR . 16.5 m -135.71 -179.92 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 44.2 p -136.87 -5.79 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.45 -124.16 5.32 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.585 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 80.5 p -129.48 9.76 5.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.733 0.302 . . . . 0.0 111.063 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.543 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 23.2 p -136.47 138.84 41.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.194 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.414 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.47 155.86 36.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.2 m -129.76 125.3 35.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.16 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.613 HG13 HG23 ' A' ' 602' ' ' THR . 2.5 mt -121.68 119.61 59.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -107.42 173.64 6.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.03 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.66 59.09 8.05 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.612 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.4 mt -119.01 114.03 21.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.713 0.292 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -65.21 133.67 52.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.526 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -67.15 173.18 3.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.197 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.69 35.32 25.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.049 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.3 m -140.36 142.92 35.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.459 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 t -99.95 111.92 24.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -105.25 127.6 53.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.552 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.694 HG23 ' HB1' ' A' ' 639' ' ' ALA . 0.1 OUTLIER -104.44 109.87 21.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.255 179.122 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -102.19 161.71 13.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.331 0.586 . . . . 0.0 112.222 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.4 p -150.83 148.87 29.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.524 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.622 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -110.14 151.64 12.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.052 0.453 . . . . 0.0 111.784 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -139.93 150.18 44.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.006 -179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.477 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -112.17 121.84 46.07 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.898 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.44 158.42 22.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.25 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.03 171.12 8.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . 0.539 ' HB3' HG21 ' A' ' 590' ' ' THR . . . -89.75 60.53 5.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.108 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -158.92 -43.78 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.68 16.37 0.61 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.496 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -111.99 125.11 53.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.339 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 28.4 m -119.67 142.65 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.355 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 31.7 p -77.68 -172.68 2.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.766 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.531 ' N ' ' HB1' ' A' ' 562' ' ' ALA . . . -79.01 167.95 20.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.843 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -87.3 128.99 35.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.066 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.511 ' HG ' ' H ' ' A' ' 638' ' ' ASN . 1.5 t -65.7 179.49 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.511 ' H ' ' HG ' ' A' ' 637' ' ' SER . 0.2 OUTLIER -64.61 157.6 26.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.727 179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.694 ' HB1' HG23 ' A' ' 621' ' ' THR . . . -89.24 138.5 31.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.16 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.02 108.63 25.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.044 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.08 111.77 17.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.38 129.04 74.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -101.82 115.79 31.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.526 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 35.9 p . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.744 0.307 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.32 -158.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.6 2.2 . . . . 0.0 112.42 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 5.3 m -114.31 125.32 53.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.995 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.487 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.2 122.88 66.79 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.04 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.436 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.0 Cg_exo -48.42 159.33 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.539 2.159 . . . . 0.0 112.109 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' THR . . . . . 0.512 HG23 ' HG1' ' A' ' 581' ' ' THR . 0.0 OUTLIER -157.6 169.97 23.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.838 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.451 ' H ' ' HG1' ' A' ' 564' ' ' THR . 5.5 m-80 59.03 40.46 22.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.798 HD13 ' HG ' ' A' ' 578' ' ' LEU . 66.2 tp -66.79 157.41 32.97 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.725 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -162.36 -179.38 6.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.7 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 6.4 p -134.9 122.54 22.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.077 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.6 p -100.78 -88.2 0.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.745 0.307 . . . . 0.0 111.65 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.663 ' HB1' ' HG1' ' A' ' 577' ' ' THR . . . -84.22 100.36 11.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.276 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.623 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.1 OUTLIER -118.48 114.15 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.745 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 13.2 p -100.77 -156.87 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.06 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.59 22.45 9.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.363 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 68.0 p -160.02 -49.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -113.28 131.08 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.024 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.623 HG13 ' HB2' ' A' ' 571' ' ' GLN . 17.2 tt -118.6 146.1 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.087 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.663 ' HG1' ' HB1' ' A' ' 570' ' ' ALA . 31.6 m -104.5 138.77 40.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.755 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.798 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -126.37 133.94 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.3 t -128.47 143.06 50.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.523 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.436 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 41.4 p90 -158.33 169.57 24.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.851 0.358 . . . . 0.0 111.169 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 581' ' ' THR . . . . . 0.512 ' HG1' HG23 ' A' ' 564' ' ' THR . 73.5 p -80.08 114.51 19.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.162 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.9 158.76 6.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.149 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.26 147.55 44.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.96 -5.61 49.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -126.35 73.27 1.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -85.31 18.87 2.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.3 p -81.14 -15.06 12.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.37 -24.31 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.608 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 11.8 t -61.67 143.51 14.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.774 0.321 . . . . 0.0 111.207 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 4.7 t -113.48 -15.98 12.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 171.24 -174.54 44.91 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.718 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -131.04 128.85 41.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.075 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.48 ' OD1' HG22 ' A' ' 603' ' ' THR . 4.2 m-20 -111.14 117.8 34.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.427 ' H ' HG11 ' A' ' 594' ' ' VAL . 0.2 OUTLIER -99.34 139.0 22.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.999 0.428 . . . . 0.0 111.103 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.484 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.2 m-85 -99.4 150.29 22.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.231 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -113.7 84.53 2.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.961 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.82 -65.45 1.19 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.093 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -154.74 -27.04 0.12 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.755 0.312 . . . . 0.0 111.152 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -100.01 153.07 19.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 600' ' ' LEU . 1.5 tm? -58.25 131.34 50.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.937 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.35 -105.96 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.625 HG23 HG13 ' A' ' 611' ' ' ILE . 3.8 t -90.49 166.68 13.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.954 0.407 . . . . 0.0 111.416 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.483 ' H ' ' HG1' ' A' ' 602' ' ' THR . 53.9 m -130.32 124.32 32.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.445 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.2 m -130.59 -177.68 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.293 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.457 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 50.6 p -142.4 -0.86 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -111.79 -144.78 9.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.669 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.6 25.1 11.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.752 0.31 . . . . 0.0 111.168 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -147.27 162.58 38.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.445 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.6 149.99 36.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.737 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 5.1 m -132.45 118.01 18.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.625 HG13 HG23 ' A' ' 602' ' ' THR . 4.5 mp -99.55 136.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.692 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 612' ' ' SER . . . . . 0.468 ' N ' HG23 ' A' ' 611' ' ' ILE . 0.3 OUTLIER -99.84 -172.21 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.962 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.21 -103.29 0.77 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 1.1 mp 57.86 177.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.027 0.442 . . . . 0.0 111.537 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -169.82 129.22 0.96 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.927 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -55.12 163.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.4 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.54 31.96 21.61 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.234 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.2 148.17 41.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.904 0.383 . . . . 0.0 111.432 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.49 140.13 38.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.515 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -134.89 130.18 35.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.315 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 38.3 p -105.39 108.33 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.149 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.479 ' O ' HG21 ' A' ' 623' ' ' THR . 70.1 m-85 -99.9 160.2 14.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.272 0.558 . . . . 0.0 112.085 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.492 HG22 ' O ' ' A' ' 637' ' ' SER . 1.3 p -154.08 136.07 14.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.814 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.45 HG21 HD12 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.41 151.94 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.012 0.434 . . . . 0.0 111.661 -179.346 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.484 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 8.4 mmtt -140.42 134.03 30.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.095 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.413 ' HB1' ' OG ' ' A' ' 634' ' ' SER . . . -92.77 123.41 36.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -117.98 143.86 46.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.041 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.484 ' OD1' ' HB2' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -110.5 160.05 16.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.859 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.31 57.59 4.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.093 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . 0.484 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . . . -157.96 -39.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 133.44 32.35 0.39 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.732 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -122.53 100.62 7.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.784 0.326 . . . . 0.0 111.061 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.3 t -99.87 119.02 47.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.413 ' OG ' ' HB1' ' A' ' 626' ' ' ALA . 24.8 p -67.29 -173.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.979 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.487 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.97 166.4 21.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.274 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.45 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.38 142.7 32.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.492 ' O ' HG22 ' A' ' 623' ' ' THR . 0.3 OUTLIER -74.65 175.55 7.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.044 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.471 HD22 ' H ' ' A' ' 566' ' ' LEU . 3.7 p30 -60.29 150.94 28.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.592 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.87 137.57 36.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -116.94 112.31 38.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.913 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 15.2 t -89.15 109.34 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.0 144.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.84 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.845 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.135 -179.988 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.524 0.202 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -68.52 -169.82 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.407 2.071 . . . . 0.0 112.354 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 59.2 m -87.19 120.29 28.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.492 ' HB3' ' N ' ' A' ' 635' ' ' ALA . . . -63.15 129.55 93.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.107 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.582 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 71.0 Cg_exo -48.01 160.61 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.681 2.254 . . . . 0.0 112.173 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.0 t -145.47 163.69 33.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.309 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 59.68 34.27 22.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.715 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.694 HD13 HG13 ' A' ' 640' ' ' VAL . 2.3 tm? -62.95 119.53 9.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.258 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -147.61 152.08 37.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 111.334 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.1 p -93.78 137.76 32.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.2 p -107.49 -87.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.53 108.38 19.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.885 179.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.03 134.55 54.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.141 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.5 p -108.49 -157.2 0.61 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.865 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -12.23 35.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.324 -179.813 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 98.0 p -130.62 -44.87 1.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.298 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -101.47 170.78 7.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.03 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.465 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.3 tt -160.44 146.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 87.8 m -118.41 114.04 22.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.824 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.469 HD21 HD22 ' A' ' 566' ' ' LEU . 9.3 mt -101.69 137.76 39.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.068 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 24.5 p -125.59 143.84 50.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.437 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.473 ' CE2' HG12 ' A' ' 624' ' ' VAL . 46.5 p90 -155.32 169.72 23.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.365 . . . . 0.0 111.124 -179.704 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.63 139.26 32.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.36 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.63 179.17 2.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.217 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 t -80.92 138.61 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 53.3 p -74.07 -1.14 18.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -105.34 -67.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.809 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.652 ' HA ' HG21 ' A' ' 589' ' ' VAL . 46.7 t30 56.79 24.24 8.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 m -89.29 27.06 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.039 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . 167.34 -9.33 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.41 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.652 HG21 ' HA ' ' A' ' 586' ' ' ASN . 3.6 t -66.46 153.65 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -52.17 0.76 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.419 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.651 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -134.98 179.9 17.18 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.813 -179.836 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -134.75 121.62 20.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.515 ' HB3' HD12 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -100.89 126.2 47.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.6 179.757 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.66 142.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.924 0.393 . . . . 0.0 111.266 -179.495 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 81.0 m-85 -106.0 151.73 24.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.317 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -140.7 97.19 3.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.039 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 56.9 71.59 0.71 Allowed Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.627 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.2 p 47.62 31.07 1.93 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.813 0.339 . . . . 0.0 111.571 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.99 110.3 2.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.775 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.557 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.6 tt -52.22 133.92 33.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.332 -179.647 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.448 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -97.98 -100.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.559 ' HG1' ' H ' ' A' ' 603' ' ' THR . 14.4 t -90.84 167.53 12.38 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.201 0.524 . . . . 0.0 111.436 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.559 ' H ' ' HG1' ' A' ' 602' ' ' THR . 7.6 m -135.33 117.24 15.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.522 179.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 18.6 m -117.65 -172.55 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.636 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.651 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 6.1 p -143.23 -2.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.14 -117.66 4.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.479 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -16.77 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.696 0.284 . . . . 0.0 111.315 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 74.5 p -108.02 167.87 9.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.942 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -152.32 128.23 10.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.046 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.4 m -108.66 119.51 39.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.272 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.465 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.5 mp -108.48 138.21 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.3 p -121.13 175.59 6.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.898 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.09 61.51 5.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.667 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 9.5 mt -131.2 124.78 31.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -77.5 140.21 39.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.447 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -72.98 164.55 26.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.167 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.06 44.59 25.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.057 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.6 m -139.98 149.78 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -86.17 134.65 33.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.549 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -132.75 152.77 51.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.215 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -137.75 104.68 5.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.202 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.502 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 78.5 m-85 -100.52 176.49 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.292 0.568 . . . . 0.0 112.12 -178.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.403 HG21 ' O ' ' A' ' 637' ' ' SER . 0.1 OUTLIER -173.73 168.72 4.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.71 179.641 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.473 HG12 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -131.16 151.36 35.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.068 0.461 . . . . 0.0 111.634 -179.899 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.522 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 8.9 mmtt -140.7 123.24 16.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.151 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.582 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -79.42 132.88 36.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.096 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -119.97 144.99 47.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.779 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -107.57 166.83 10.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.127 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.24 34.65 0.74 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.191 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -140.11 4.74 2.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.058 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.93 30.99 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.773 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.84 124.74 52.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.665 0.269 . . . . 0.0 110.788 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 12.4 p -116.45 134.53 59.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 111.244 179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.468 ' HG ' ' HA ' ' A' ' 562' ' ' ALA . 21.4 p -76.89 -166.11 0.64 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.707 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.492 ' N ' ' HB3' ' A' ' 562' ' ' ALA . . . -87.69 173.03 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.895 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.522 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -86.49 133.88 33.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.2 -179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.403 ' O ' HG21 ' A' ' 623' ' ' THR . 0.3 OUTLIER -63.46 178.74 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.922 179.783 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.01 149.23 19.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.384 179.601 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.64 129.0 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.429 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.694 HG13 HD13 ' A' ' 566' ' ' LEU . 7.9 p -108.38 140.73 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.95 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 641' ' ' SER . . . . . 0.403 ' N ' HG23 ' A' ' 640' ' ' VAL . 0.3 OUTLIER -106.52 102.87 12.23 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.396 179.728 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.401 HG22 ' CD1' ' A' ' 576' ' ' ILE . 47.2 t -99.31 114.33 37.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.248 -179.494 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.07 101.07 10.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.613 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.447 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 68.3 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.201 -179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.46 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.669 0.271 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.32 -159.72 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.457 2.105 . . . . 0.0 112.101 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.443 ' HG1' ' HG ' ' A' ' 583' ' ' SER . 0.3 OUTLIER -110.1 134.59 52.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.208 -179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.56 128.82 93.85 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.454 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 83.3 Cg_exo -45.23 136.65 10.88 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.697 2.265 . . . . 0.0 112.074 179.578 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.9 p -119.05 149.67 41.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.7 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 10.0 m120 55.94 61.96 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.483 179.468 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.619 HD11 ' HB3' ' A' ' 580' ' ' TRP . 33.1 tp -65.71 159.17 25.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.298 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.511 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.03 177.24 10.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.035 0.445 . . . . 0.0 111.636 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 568' ' ' SER . . . . . 0.458 ' HB2' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -133.6 150.74 51.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.465 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -120.52 -90.35 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.447 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.0 97.26 11.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.229 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.458 ' NE2' ' HB2' ' A' ' 568' ' ' SER . 1.5 mp0 -113.72 102.71 10.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.828 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 8.6 p -88.17 -162.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.239 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.65 19.0 7.89 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.661 -179.569 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.528 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 8.9 p -158.89 -44.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.79 0.329 . . . . 0.0 111.204 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 65.3 p -113.92 122.2 46.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.413 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 18.1 tt -109.17 138.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.168 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 14.3 m -112.9 116.11 29.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 59.5 mt -103.73 156.5 17.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.947 0.403 . . . . 0.0 111.182 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.1 p -145.0 138.91 27.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.04 179.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.619 ' HB3' HD11 ' A' ' 566' ' ' LEU . 41.8 p90 -144.8 169.83 17.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.971 0.415 . . . . 0.0 111.52 -179.34 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -80.53 126.65 31.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.144 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.21 163.4 4.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.462 ' HG ' ' H ' ' A' ' 585' ' ' ASP . 1.6 t -88.08 133.06 34.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -8.16 37.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.183 179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.462 ' H ' ' HG ' ' A' ' 583' ' ' SER . 1.1 m-20 -100.1 54.98 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.958 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -71.15 -135.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.674 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.1 t 52.6 20.6 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 121.119 0.485 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -171.1 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.851 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 57.8 t -65.25 117.55 6.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.764 0.316 . . . . 0.0 110.422 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.0 t -101.06 -35.41 9.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.541 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -158.03 178.44 34.31 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.216 -0.992 . . . . 0.0 113.223 -179.616 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 626' ' ' ALA . 90.6 m-85 -124.94 155.13 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.763 0.315 . . . . 0.0 110.857 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -131.39 117.8 19.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.422 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.508 HG21 ' N ' ' A' ' 595' ' ' TYR . 0.2 OUTLIER -99.68 143.81 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.916 0.388 . . . . 0.0 111.289 -179.575 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.574 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 92.1 m-85 -108.97 156.2 19.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.45 -179.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -118.19 84.04 2.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.152 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.51 -51.43 4.4 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.209 -179.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.11 -43.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 0.0 111.125 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -80.06 172.39 13.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.2 tp -90.79 126.98 36.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.322 179.198 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.43 -107.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.859 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.459 HG21 HG13 ' A' ' 611' ' ' ILE . 2.9 t -91.54 164.95 13.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.216 0.532 . . . . 0.0 111.495 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -131.06 106.74 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.332 179.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 34.6 m -111.15 -177.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.638 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.541 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.5 p -137.47 -20.08 1.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.795 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -81.15 -116.04 0.37 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.719 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.63 -5.12 2.88 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 -179.653 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 1.7 p -122.2 156.86 32.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.199 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -134.53 129.74 35.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.032 179.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.4 m -110.02 125.99 53.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.188 -179.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.459 HG13 HG21 ' A' ' 602' ' ' THR . 2.9 mp -111.04 136.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.955 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 82.2 p -113.88 178.0 4.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.24 36.19 92.91 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.447 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.7 OUTLIER -87.88 -174.23 4.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 110.992 -179.903 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -147.29 158.04 43.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -88.91 157.32 18.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.213 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.66 43.37 28.22 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.089 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 10.7 m -140.31 144.13 36.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.457 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.9 p -90.58 140.48 29.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.262 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -135.12 122.66 22.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.828 0.347 . . . . 0.0 111.711 -179.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -102.88 105.51 15.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.91 178.852 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -100.17 176.38 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.399 0.618 . . . . 0.0 112.442 -178.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.18 155.5 5.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.619 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.454 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -119.45 159.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.932 0.396 . . . . 0.0 111.538 -179.743 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.574 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mmtt -140.75 113.34 8.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.211 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.501 ' HB3' ' CE2' ' A' ' 592' ' ' TYR . . . -79.51 119.39 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.52 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.83 166.43 12.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.784 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.15 164.23 20.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.61 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.63 57.38 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.97 -19.02 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.082 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 113.09 26.15 4.18 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.269 -179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 4.4 m120 -121.81 121.25 36.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.748 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 634' ' ' SER . 2.3 p -138.91 134.59 42.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.225 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.445 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.19 -176.5 3.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.828 179.908 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.469 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -74.68 176.17 7.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.044 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.552 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -73.54 154.72 39.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.078 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.3 p -79.85 -163.27 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.758 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.79 146.99 41.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.98 23.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.928 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.5 p -102.9 134.53 43.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.262 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.5 m -109.32 105.92 15.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.337 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.24 130.32 63.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.417 ' O ' ' HG3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -96.45 121.66 38.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.102 -179.75 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.452 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.577 0.227 . . . . 0.0 111.108 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.22 -165.76 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.642 2.228 . . . . 0.0 112.237 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.33 150.69 19.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.765 179.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.535 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -84.11 125.95 71.19 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.416 -179.748 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.617 ' HB2' ' HG ' ' A' ' 637' ' ' SER . 81.2 Cg_exo -48.31 154.57 2.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.686 2.257 . . . . 0.0 112.009 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.26 163.08 33.95 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.07 0.462 . . . . 0.0 111.664 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.94 52.74 11.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.06 179.122 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.662 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 2.0 tp -74.23 156.95 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.051 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.662 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 -177.99 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.518 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 83.9 p -133.76 129.04 36.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.653 179.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 76.1 p -111.43 -72.53 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.383 -179.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.26 96.3 10.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.351 . . . . 0.0 110.905 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.533 ' HA ' ' HA ' ' A' ' 576' ' ' ILE . 0.7 OUTLIER -123.39 105.64 9.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 17.0 p -85.69 -155.2 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.919 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.0 m -88.04 -37.34 16.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 16.0 p -115.0 -2.61 12.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.669 0.271 . . . . 0.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.99 165.41 25.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.954 179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.681 HG21 HD11 ' A' ' 611' ' ' ILE . 16.4 tt -160.06 148.71 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.9 m -132.66 124.03 27.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.659 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 566' ' ' LEU . 23.7 mt -107.47 153.28 23.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.398 . . . . 0.0 111.486 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.7 t -133.38 135.23 44.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.051 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.477 ' HB3' HD13 ' A' ' 566' ' ' LEU . 46.5 p90 -143.48 169.89 16.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.473 -179.268 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 m -82.05 115.87 21.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.213 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -62.55 157.25 20.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.018 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.6 146.29 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.757 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 74.5 p -82.56 20.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.126 179.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.437 ' O ' HG22 ' A' ' 589' ' ' VAL . 9.2 m-20 -140.17 71.32 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.696 179.918 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.94 22.25 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -85.45 6.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -155.85 -25.67 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.401 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 585' ' ' ASP . 16.8 t -66.26 140.53 19.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.83 0.348 . . . . 0.0 111.173 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 22.3 p -115.48 -51.49 2.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.17 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.555 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -144.24 179.55 21.45 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.597 -179.947 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -131.28 120.36 23.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 111.016 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.75 122.17 42.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.419 179.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 602' ' ' THR . 0.1 OUTLIER -102.01 138.17 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.971 0.415 . . . . 0.0 111.267 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.73 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 96.1 m-85 -99.27 162.04 13.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.655 179.912 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -140.32 88.96 2.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 62.55 69.02 1.42 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.995 -179.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p 50.23 35.02 9.59 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.008 0.432 . . . . 0.0 111.115 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.31 102.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.775 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.689 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -48.87 122.99 6.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.291 -179.654 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -92.89 -98.95 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.198 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.534 HG22 HG11 ' A' ' 594' ' ' VAL . 9.4 t -90.8 169.07 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.133 0.492 . . . . 0.0 111.669 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.16 109.07 6.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.455 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.493 HG13 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -108.42 -170.59 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.789 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.555 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 32.0 p -140.51 2.47 1.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.834 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.1 -134.05 5.56 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.475 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 52.5 p -112.5 -4.03 14.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.768 0.318 . . . . 0.0 111.238 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.509 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 1.4 p -119.1 152.75 35.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.122 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.525 ' O ' ' HA ' ' A' ' 577' ' ' THR . . . -136.26 124.02 22.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 9.2 m -106.56 134.41 49.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.347 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.681 HD11 HG21 ' A' ' 576' ' ' ILE . 4.4 mp -121.01 138.6 50.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 612' ' ' SER . . . . . 0.487 ' N ' HG21 ' A' ' 611' ' ' ILE . 14.1 m -117.76 162.36 18.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.793 179.907 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.49 79.1 0.22 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.321 -179.761 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 1.2 tp -135.18 154.86 51.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 111.081 -179.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . 0.487 ' HB3' ' HG1' ' A' ' 618' ' ' THR . . . -92.05 163.36 14.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.059 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -89.52 156.9 18.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.912 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 2.6 p30 40.57 58.09 2.44 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.504 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 618' ' ' THR . . . . . 0.505 ' H ' ' HG1' ' A' ' 644' ' ' THR . 3.6 m -134.29 148.68 50.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.077 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 78.9 p -87.06 130.21 34.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.746 179.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . 0.436 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 69.5 m-85 -134.63 135.21 41.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.959 0.409 . . . . 0.0 111.645 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 43.3 p -114.62 128.13 56.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.857 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.471 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 76.2 m-85 -120.08 168.94 10.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.458 0.647 . . . . 0.0 112.274 -178.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -167.42 152.67 7.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.314 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.442 HG11 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -118.97 155.86 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 112.266 -179.266 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.73 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 5.7 mmtp -140.77 142.68 34.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.757 -179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.52 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -101.33 128.2 47.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.489 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.444 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.52 140.29 50.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 179.65 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.61 167.99 9.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.75 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -66.36 -31.32 72.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.89 -179.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.2 10.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.569 -179.38 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 76.81 69.82 1.35 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.508 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.452 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 71.6 m-80 -148.2 124.04 10.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.685 0.278 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 25.7 m -112.59 139.44 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.044 0.45 . . . . 0.0 111.693 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 2.0 p -83.8 -164.93 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.248 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.535 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.94 161.33 23.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.73 0.3 . . . . 0.0 110.814 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.625 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -74.1 144.23 45.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.865 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.617 ' HG ' ' HB2' ' A' ' 563' ' ' PRO . 0.2 OUTLIER -72.15 -163.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.19 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.27 142.09 34.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.844 179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' A' ' 622' ' ' PHE . . . -79.65 116.22 19.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.065 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 621' ' ' THR . 11.6 p -101.03 131.82 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.129 -179.942 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 45.8 t -106.28 113.78 27.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.1 147.75 26.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.432 -179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -111.46 116.07 30.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.856 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.505 ' HG1' ' H ' ' A' ' 618' ' ' THR . 5.4 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.183 179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.708 0.29 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -83.34 -158.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.731 2.288 . . . . 0.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 3.4 m -115.91 133.94 55.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.067 179.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 635' ' ' ALA . . . -64.54 127.33 92.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.247 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.434 ' HD3' ' HB1' ' A' ' 626' ' ' ALA . 73.3 Cg_exo -49.36 163.63 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.737 2.292 . . . . 0.0 112.003 179.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.2 t -155.07 158.43 39.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.366 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.2 m120 58.36 49.63 10.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.287 179.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.826 HD13 ' HG ' ' A' ' 578' ' ' LEU . 6.1 tp -71.16 158.49 36.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.306 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.626 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 174.51 13.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 0.0 111.475 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 568' ' ' SER . . . . . 0.545 ' HG ' ' HG2' ' A' ' 571' ' ' GLN . 0.2 OUTLIER -129.9 142.8 50.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.619 179.589 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.13 -78.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.277 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.67 96.53 10.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.186 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.545 ' HG2' ' HG ' ' A' ' 568' ' ' SER . 0.0 OUTLIER -115.03 97.6 6.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.92 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 61.1 p -92.63 -163.61 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 46.2 p -90.52 24.97 2.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.353 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 614' ' ' LEU . 24.9 p -163.83 -49.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.017 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.06 160.14 14.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.448 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.5 tt -151.18 137.08 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.926 0.394 . . . . 0.0 111.176 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -106.17 131.36 53.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.567 179.63 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.826 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -120.81 128.24 52.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.532 -179.208 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.6 t -123.73 128.34 49.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.405 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.62 ' HB3' HD11 ' A' ' 566' ' ' LEU . 44.6 p90 -140.64 170.21 16.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.959 0.409 . . . . 0.0 111.456 -179.355 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.3 m -79.6 123.02 27.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.143 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.58 162.63 8.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.22 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 7.4 m -71.46 158.2 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 17.45 3.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -138.5 44.22 2.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.799 179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -60.79 -12.87 12.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.162 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.7 -9.92 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.041 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.0 -29.82 0.6 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.569 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 7.4 t -65.31 145.48 13.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.644 0.259 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.4 t -117.64 -34.32 4.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.477 -179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.706 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -157.46 169.43 34.4 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.16 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -122.63 126.15 47.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.727 0.298 . . . . 0.0 110.763 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.606 ' HB3' HD13 ' A' ' 600' ' ' LEU . 1.3 m-20 -101.54 116.62 33.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.632 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.65 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.32 139.95 19.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.982 0.42 . . . . 0.0 111.106 -179.599 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.401 ' CE1' ' HG3' ' A' ' 625' ' ' LYS . 86.8 m-85 -102.21 146.58 27.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.278 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.553 ' HB2' ' HB1' ' A' ' 601' ' ' ALA . 0.2 OUTLIER -101.67 84.59 2.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.179 179.105 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.13 -55.82 4.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.349 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.5 p -147.56 -56.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.774 0.321 . . . . 0.0 111.033 179.86 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.69 174.12 11.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.606 HD13 ' HB3' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -82.02 154.15 25.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.906 0.384 . . . . 0.0 110.986 -179.944 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 596' ' ' ASN . . . -141.08 -68.68 0.39 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.135 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.76 154.88 19.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.23 89.34 2.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.423 178.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.536 HG13 ' HA ' ' A' ' 609' ' ' ALA . 35.9 m -104.03 -176.03 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.613 -179.322 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.706 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.6 p -144.41 -11.56 0.62 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.111 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -96.91 -137.67 9.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.628 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.89 10.05 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.641 0.258 . . . . 0.0 111.396 -179.828 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -137.11 165.55 25.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.315 -179.902 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.536 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -141.8 150.91 42.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.158 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.6 m -134.43 118.33 17.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.303 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.448 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.5 mp -117.88 111.81 35.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.0 154.01 21.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.988 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.64 33.64 5.53 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.601 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 574' ' ' SER . 3.6 mt -107.58 155.8 19.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.783 0.325 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.68 159.97 15.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.95 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.02 179.58 5.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.401 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.18 28.39 17.68 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.077 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.15 150.47 44.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.468 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 75.3 m -100.64 121.08 41.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.29 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -114.46 129.39 56.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.993 0.425 . . . . 0.0 111.897 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.5 OUTLIER -108.75 121.91 46.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.787 178.907 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.457 ' O ' HG21 ' A' ' 623' ' ' THR . 97.1 m-85 -111.23 165.15 12.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.381 0.61 . . . . 0.0 112.395 -178.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.457 HG21 ' O ' ' A' ' 622' ' ' PHE . 7.0 p -150.44 149.99 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.709 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.65 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -117.01 152.78 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.955 0.407 . . . . 0.0 111.523 -179.769 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.7 mttt -140.62 139.79 34.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.204 -179.654 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.434 ' HB1' ' HD3' ' A' ' 563' ' ' PRO . . . -99.04 121.96 41.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.93 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.84 140.46 49.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.987 -179.813 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -105.2 175.01 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.893 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.95 15.29 4.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.293 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -113.26 6.45 17.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.976 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 80.11 9.9 86.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.475 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -102.14 125.38 48.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.43 HG21 ' N ' ' A' ' 634' ' ' SER . 7.7 p -126.89 137.94 56.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.093 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.43 ' N ' HG21 ' A' ' 633' ' ' VAL . 0.1 OUTLIER -77.1 -167.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.163 -179.759 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.504 ' O ' ' HB1' ' A' ' 562' ' ' ALA . . . -80.08 178.9 7.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.061 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.459 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.2 146.86 23.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.05 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.1 t -79.09 174.71 11.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -59.3 148.29 32.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.801 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -81.3 126.67 31.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.57 ' O ' ' HA ' ' A' ' 621' ' ' THR . 5.3 p -99.5 134.11 39.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.554 179.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.87 113.34 26.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 111.056 -179.398 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 642' ' ' VAL . 0.4 OUTLIER -122.95 131.34 73.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.901 179.826 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.39 113.99 25.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.2 -179.93 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.425 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -68.5 -172.66 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.527 2.151 . . . . 0.0 112.311 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 18.2 p -99.93 135.45 41.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.405 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.427 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -64.12 132.24 95.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.128 179.769 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.44 ' HB2' ' HB2' ' A' ' 637' ' ' SER . 81.0 Cg_exo -45.47 153.74 0.63 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.616 2.21 . . . . 0.0 112.226 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.29 151.05 44.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.943 0.401 . . . . 0.0 111.62 -179.577 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 59.39 59.71 2.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.969 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.75 HD13 ' HG ' ' A' ' 578' ' ' LEU . 63.9 tp -74.83 159.95 31.28 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.891 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -161.34 173.35 15.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.021 0.438 . . . . 0.0 111.934 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.71 129.11 36.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.307 179.381 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.8 p -106.36 -84.23 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 111.643 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.8 96.92 10.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.461 -179.426 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 644' ' ' THR . 1.8 tt0 -116.0 101.65 8.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.793 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.5 p -90.78 -157.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.072 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 40.5 p -95.24 25.21 4.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.465 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 78.8 p -167.36 -50.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.278 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.55 131.54 53.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.146 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.452 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 10.0 tt -121.99 143.31 35.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -107.15 117.01 32.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.579 179.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.75 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -108.63 134.99 50.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.149 -179.526 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -130.01 136.52 49.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.447 ' CZ2' HG13 ' A' ' 624' ' ' VAL . 36.1 p90 -148.59 169.78 19.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.902 0.382 . . . . 0.0 111.122 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 5.5 m -82.14 116.52 21.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.963 179.684 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . 0.42 ' HB1' ' HH ' ' A' ' 592' ' ' TYR . . . -61.25 155.25 21.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.048 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 m -59.46 120.61 9.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.79 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -15.96 61.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.9 -66.14 0.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.865 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 49.5 t30 57.71 -133.69 1.19 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.772 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . 0.404 ' O ' HG13 ' A' ' 587' ' ' VAL . 3.8 p 45.1 23.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 111.655 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.44 -21.13 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.084 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.7 t -76.34 134.18 29.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.789 0.328 . . . . 0.0 110.713 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.89 -48.22 4.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.314 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.505 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.12 -179.35 26.77 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.87 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.42 ' HH ' ' HB1' ' A' ' 582' ' ' ALA . 68.7 m-85 -126.42 132.5 51.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 -179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.36 123.19 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.389 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.602 ' HB ' HG11 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.86 137.57 26.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.889 0.376 . . . . 0.0 111.228 -179.509 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.436 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 93.0 m-85 -99.47 145.39 27.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -114.92 89.74 3.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.368 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.56 -70.9 3.02 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.129 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.5 p -148.11 -16.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.865 0.364 . . . . 0.0 110.888 179.73 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -115.53 134.75 54.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 179.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.35 147.67 2.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.345 -179.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -115.33 -106.65 0.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.173 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.431 ' HG1' ' H ' ' A' ' 603' ' ' THR . 6.5 t -90.92 168.07 11.96 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.205 0.526 . . . . 0.0 111.854 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.431 ' H ' ' HG1' ' A' ' 602' ' ' THR . 88.7 m -128.92 130.84 47.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.313 179.756 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 608' ' ' THR . 13.6 m -132.77 -177.7 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.501 -179.365 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.505 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 34.7 p -145.53 17.67 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.974 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -128.05 -121.85 2.44 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.761 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 607' ' ' THR . . . . . 0.432 HG21 ' O ' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -128.95 9.3 5.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.627 0.251 . . . . 0.0 111.41 -179.739 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.524 ' O ' HG13 ' A' ' 604' ' ' VAL . 1.1 p -139.72 140.08 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.36 -179.879 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.413 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -122.48 148.0 45.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.5 m -122.01 109.08 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.278 -179.896 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.452 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -102.34 126.71 56.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.096 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 164.97 13.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.864 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.85 47.78 5.18 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.473 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.5 mt -119.38 152.25 37.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 110.918 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.7 152.12 35.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.151 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -77.93 174.91 10.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.4 t0 56.86 25.55 10.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.14 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.72 161.57 32.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.054 179.827 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 47.5 t -121.94 137.28 54.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.82 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -135.62 172.54 12.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.943 0.401 . . . . 0.0 111.491 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.55 110.65 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.105 179.496 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.609 ' HD2' HG22 ' A' ' 642' ' ' VAL . 78.6 m-85 -99.73 165.65 11.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.227 0.537 . . . . 0.0 111.959 -178.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -159.62 153.07 22.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.882 179.628 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.602 HG11 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -118.57 150.12 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.924 0.392 . . . . 0.0 111.345 -179.763 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.436 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.3 mttt -136.0 150.16 49.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.083 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -106.26 129.27 54.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.223 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.464 ' HB3' HG11 ' A' ' 633' ' ' VAL . 1.9 ptmm? -127.78 142.62 51.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.28 169.72 8.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 179.848 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.62 48.7 1.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.74 3.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.084 179.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.84 61.81 1.74 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.458 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.8 m120 -145.48 106.98 4.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.646 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 627' ' ' LYS . 29.4 m -118.82 137.98 51.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.378 -179.823 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.427 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -87.95 -167.0 1.74 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.718 179.808 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -73.0 170.95 13.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -83.14 138.78 33.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.78 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.46 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.51 179.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.234 -179.847 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.24 148.44 27.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.69 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.97 128.39 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.003 -179.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.3 m -109.73 115.08 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.268 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 19.6 m -79.81 100.95 8.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.287 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.609 HG22 ' HD2' ' A' ' 622' ' ' PHE . 63.6 t -99.86 108.79 23.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.37 -179.458 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 95.0 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.529 ' HA ' ' NE2' ' A' ' 571' ' ' GLN . 19.8 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.18 -179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.63 0.252 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.4 ' HB2' ' H ' ' A' ' 561' ' ' THR . 69.6 Cg_endo -73.45 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.562 2.175 . . . . 0.0 111.958 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.754 HG22 ' HB2' ' A' ' 585' ' ' ASP . 2.2 p -107.52 136.88 46.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.889 0.376 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 635' ' ' ALA . . . -67.18 129.9 93.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.305 -179.783 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.431 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 85.3 Cg_exo -47.28 152.48 2.21 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.729 2.286 . . . . 0.0 111.854 179.277 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.96 161.76 34.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.34 -179.652 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 61.1 34.05 19.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.938 179.639 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.857 HD13 HG11 ' A' ' 640' ' ' VAL . 1.6 tm? -69.15 117.51 10.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.117 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -144.74 145.97 31.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.232 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 2.1 p -84.83 150.74 24.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 179.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 6.2 p -124.29 -86.43 0.63 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.277 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.9 99.46 12.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.014 -179.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.52 ' HG3' HD11 ' A' ' 576' ' ' ILE . 1.6 tt0 -119.43 140.13 50.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.043 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 36.5 p -128.45 -167.85 1.83 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.895 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 6.1 p -87.38 32.98 0.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.189 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 23.2 p -169.46 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.315 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -110.69 135.97 50.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.248 -179.677 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.52 HD11 ' HG3' ' A' ' 571' ' ' GLN . 13.8 tt -127.71 139.32 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.78 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 20.7 m -110.27 122.2 47.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.135 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 608' ' ' THR . 13.1 mt -109.1 141.47 41.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.969 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.5 t -132.29 133.54 44.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.545 ' HB3' HD22 ' A' ' 566' ' ' LEU . 37.3 p90 -144.76 169.66 17.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.198 -179.599 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.7 m -84.69 128.25 34.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.199 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.24 25.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.047 179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 94.5 p -61.49 150.19 36.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.899 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 584' ' ' THR . . . . . 0.43 ' H ' ' HG1' ' A' ' 561' ' ' THR . 30.7 p -85.61 11.64 10.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.01 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.754 ' HB2' HG22 ' A' ' 561' ' ' THR . 0.4 OUTLIER -119.38 45.08 2.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.923 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.489 ' C ' ' H ' ' A' ' 588' ' ' GLY . 73.1 m-20 -65.11 -164.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.962 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 587' ' ' VAL . 11.2 t 66.41 -4.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.118 0.485 . . . . 0.0 110.906 -179.771 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -142.24 -16.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 585' ' ' ASP . 89.3 t -82.49 146.57 6.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.67 0.272 . . . . 0.0 110.781 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.536 HG21 ' H ' ' A' ' 591' ' ' GLY . 1.3 t -106.08 -54.41 2.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.638 -179.638 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.536 ' H ' HG21 ' A' ' 590' ' ' THR . . . -151.71 -172.21 20.28 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.137 -179.563 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.494 ' O ' HG22 ' A' ' 604' ' ' VAL . 89.4 m-85 -131.01 129.26 41.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.791 0.329 . . . . 0.0 110.586 -179.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.18 117.67 34.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.474 ' H ' HG11 ' A' ' 594' ' ' VAL . 0.2 OUTLIER -99.83 137.01 28.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.804 -179.892 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.588 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 33.9 m-85 -101.9 175.06 5.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.315 -179.444 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . 0.412 HD22 ' HD1' ' A' ' 620' ' ' TYR . 6.7 t-20 -140.48 89.3 2.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.737 179.666 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 85.32 -68.84 3.38 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.305 -179.736 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -150.3 -18.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.902 0.382 . . . . 0.0 110.638 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -114.6 135.25 54.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.742 179.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.588 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.1 tp -51.94 144.22 12.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.218 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -110.96 -98.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.101 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.443 ' CG2' HG12 ' A' ' 594' ' ' VAL . 2.9 t -90.83 160.2 15.87 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.108 0.48 . . . . 0.0 111.645 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 15.9 m -125.97 122.62 36.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.167 179.551 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 592' ' ' TYR . 30.1 m -127.83 -174.74 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.062 0.458 . . . . 0.0 111.998 -178.918 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.525 HG21 ' HA3' ' A' ' 591' ' ' GLY . 6.2 p -146.59 -2.29 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.889 179.843 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.49 -134.15 6.64 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.717 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.47 30.16 7.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.776 0.322 . . . . 0.0 111.242 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -157.77 141.17 15.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.215 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.403 ' HB2' HG22 ' A' ' 602' ' ' THR . . . -123.78 155.97 36.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.81 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 16.6 m -137.06 124.51 22.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.241 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.583 HG22 HD11 ' A' ' 614' ' ' LEU . 4.7 mp -113.68 128.34 70.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.96 171.08 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 61.02 64.81 3.74 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.675 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.583 HD11 HG22 ' A' ' 611' ' ' ILE . 0.4 OUTLIER -115.51 132.44 56.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.828 0.347 . . . . 0.0 110.868 -179.989 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . 0.422 ' H ' ' HH ' ' A' ' 620' ' ' TYR . . . -99.44 134.72 41.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.116 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.12 168.23 16.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 16.2 t0 59.66 29.08 18.63 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.019 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.9 m -134.79 142.23 46.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.168 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 26.3 t -84.09 143.66 29.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.738 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . 0.422 ' HH ' ' H ' ' A' ' 615' ' ' ALA . 59.8 m-85 -136.87 142.35 42.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.151 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.4 p -132.57 114.2 13.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.289 179.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.534 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 81.3 m-85 -109.13 166.88 10.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.283 0.563 . . . . 0.0 111.905 -179.203 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -169.26 127.17 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.693 179.603 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.51 ' H ' ' HG ' ' A' ' 637' ' ' SER . 0.6 OUTLIER -99.36 149.55 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.491 . . . . 0.0 111.926 -179.056 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.517 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.1 mttt -128.24 166.36 18.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.332 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -116.06 123.78 48.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -121.38 154.44 36.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.829 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 171.74 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.57 47.69 1.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.361 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -153.92 -30.85 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.056 179.86 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 125.11 28.25 1.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.573 179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -112.7 120.29 41.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.77 0.319 . . . . 0.0 110.702 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.7 147.75 24.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.33 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.3 t -89.95 -154.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.524 179.68 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.445 ' O ' ' HB1' ' A' ' 562' ' ' ALA . . . -84.0 -179.5 7.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 179.725 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.517 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.15 140.3 29.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.371 . . . . 0.0 111.023 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.51 ' HG ' ' H ' ' A' ' 624' ' ' VAL . 4.9 p -68.45 -172.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.014 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.71 145.37 52.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.747 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.17 119.19 22.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.857 HG11 HD13 ' A' ' 566' ' ' LEU . 7.3 p -101.12 123.95 54.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.041 179.855 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.3 t -105.58 106.14 16.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.862 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -113.36 125.45 70.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.259 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.92 101.68 12.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 70.9 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.254 -179.963 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.462 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.721 0.296 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.449 ' HB3' HG23 ' A' ' 589' ' ' VAL . 69.1 Cg_endo -74.09 -168.74 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.512 2.141 . . . . 0.0 111.817 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.748 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 70.2 m -109.81 113.27 25.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.173 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.33 64.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.737 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.519 ' HD3' ' HB3' ' A' ' 626' ' ' ALA . 86.4 Cg_exo -46.98 160.33 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.602 2.201 . . . . 0.0 112.381 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.8 t -155.28 157.81 37.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.555 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 11.3 t30 58.46 43.16 19.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.432 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.769 HD11 ' HG ' ' A' ' 578' ' ' LEU . 51.7 tp -61.45 160.58 10.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.303 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.472 ' O ' HD11 ' A' ' 578' ' ' LEU . . . -161.21 173.7 14.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 111.774 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.6 p -126.13 136.31 52.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.6 p -110.65 -86.88 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.534 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.16 98.5 11.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.819 0.342 . . . . 0.0 111.348 -179.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.423 ' HB3' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.12 104.09 10.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.844 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.8 p -103.83 -170.08 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 71.5 p -91.74 41.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.6 p -168.65 -42.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.259 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -135.28 137.47 42.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.136 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 610' ' ' THR . 13.7 tt -118.67 142.48 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.247 179.931 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.5 m -110.82 121.63 45.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.622 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.769 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -111.36 136.08 51.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.085 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.3 t -130.94 135.38 47.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.487 ' HB3' ' CD1' ' A' ' 566' ' ' LEU . 36.4 p90 -143.71 170.18 16.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.985 0.421 . . . . 0.0 111.428 -179.334 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.45 116.65 19.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.019 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . 0.43 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -60.74 170.06 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.266 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.748 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 2.6 p -88.33 138.91 31.02 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.996 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -13.94 62.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.337 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -110.03 59.23 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -78.24 5.2 10.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.2 p -67.57 -18.98 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.799 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -120.79 -24.98 2.43 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 179.901 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.637 HG22 ' HG ' ' A' ' 583' ' ' SER . 3.5 t -69.6 133.85 31.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.906 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 629' ' ' ALA . 2.9 t -120.28 0.52 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.439 -179.665 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.645 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.63 162.81 23.61 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.253 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.591 ' HH ' ' H ' ' A' ' 583' ' ' SER . 84.5 m-85 -122.05 145.56 48.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.811 0.338 . . . . 0.0 110.746 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.435 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 0.2 OUTLIER -123.03 124.54 43.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.723 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.18 132.6 46.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.035 0.445 . . . . 0.0 111.032 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.723 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 97.3 m-85 -99.74 149.31 23.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.954 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -131.35 100.4 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.757 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.9 69.52 1.24 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.332 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 68.1 p 48.41 29.51 2.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.925 0.393 . . . . 0.0 111.353 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -154.8 103.75 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.599 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.723 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -48.47 139.4 9.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.526 -179.451 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.38 -94.65 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.792 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.419 ' H ' HG23 ' A' ' 602' ' ' THR . 0.9 OUTLIER -91.07 163.13 14.41 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.111 0.481 . . . . 0.0 111.443 179.83 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 99.57 4.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.421 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.413 HG11 ' O ' ' A' ' 608' ' ' THR . 35.2 m -103.16 -167.88 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.648 -179.203 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.645 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.0 p -143.51 -24.03 0.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.014 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -83.33 -124.6 0.98 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.618 -179.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 607' ' ' THR . . . . . 0.43 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 0.5 OUTLIER -126.21 9.54 7.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 111.12 -179.875 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.552 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -131.19 157.63 42.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.246 -179.998 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.413 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.46 142.7 30.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.583 179.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.5 OUTLIER -125.24 131.2 53.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.557 -179.697 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.2 mp -115.83 130.39 70.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.131 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 3.2 p -99.37 -178.07 3.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.783 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 56.44 45.7 88.84 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.37 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.485 ' HA ' HD13 ' A' ' 614' ' ' LEU . 6.1 tp -97.66 148.06 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 111.133 -179.769 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.74 165.55 13.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 174.04 7.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.362 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 43.32 44.04 4.49 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.946 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.16 151.55 45.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.281 179.53 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -108.63 132.54 53.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.536 179.618 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -126.6 136.87 53.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.91 0.386 . . . . 0.0 111.411 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.37 116.26 31.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.087 179.094 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -114.0 163.6 14.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.255 0.55 . . . . 0.0 112.233 -178.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -155.72 147.18 22.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.645 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.95 152.65 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -179.625 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.584 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 4.9 mmtt -135.79 145.68 46.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.089 -179.531 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.519 ' HB3' ' HD3' ' A' ' 563' ' ' PRO . . . -109.98 115.68 30.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.462 ' HZ2' ' HG3' ' A' ' 627' ' ' LYS . 2.0 pttm -117.95 152.1 36.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.111 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -99.74 -159.3 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . 0.482 ' HA ' HG22 ' A' ' 590' ' ' THR . . . -51.56 -76.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.071 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.86 48.51 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.466 179.954 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -148.18 -66.06 0.01 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.42 -179.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 7.8 m120 -89.89 145.11 25.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.205 0.526 . . . . 0.0 111.811 -179.091 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.2 t -137.95 135.74 45.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 179.35 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 626' ' ' ALA . 0.6 OUTLIER -89.15 173.88 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.178 -179.513 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.439 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -82.39 171.65 13.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.212 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.465 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -81.14 143.36 32.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.1 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 637' ' ' SER . . . . . 0.484 ' HG ' ' H ' ' A' ' 638' ' ' ASN . 0.9 OUTLIER -78.4 -174.45 3.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.968 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.484 ' H ' ' HG ' ' A' ' 637' ' ' SER . 37.1 t30 -70.55 152.0 44.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.562 179.744 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.71 149.42 29.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.026 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.12 111.05 23.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.373 -179.888 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.0 t -89.29 112.57 23.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.68 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.28 140.52 31.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.09 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.34 100.79 10.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.845 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.102 179.977 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.661 0.267 . . . . 0.0 111.347 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . 0.497 ' HB2' ' H ' ' A' ' 561' ' ' THR . 86.9 Cg_endo -83.27 -140.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.695 2.263 . . . . 0.0 112.137 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 561' ' ' THR . . . . . 0.497 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -115.34 122.27 45.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.806 0.336 . . . . 0.0 110.853 179.661 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 635' ' ' ALA . . . -59.16 129.88 86.55 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.282 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.448 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 87.7 Cg_exo -45.8 125.39 8.01 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.66 2.24 . . . . 0.0 111.887 179.561 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 2.8 t -109.53 149.83 29.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.637 -179.431 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 m120 57.41 78.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.796 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.503 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 36.9 tp -90.35 159.27 16.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.303 179.118 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.527 ' O ' HD23 ' A' ' 578' ' ' LEU . . . -161.5 173.61 14.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.974 0.416 . . . . 0.0 111.649 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 77.6 p -124.65 143.26 50.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.326 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.31 -89.84 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.714 0.292 . . . . 0.0 111.77 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.71 103.15 11.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.602 -179.422 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.7 134.56 54.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.757 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.461 ' HB ' ' H ' ' A' ' 573' ' ' THR . 18.5 p -129.62 -161.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.793 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.5 HG23 ' HB1' ' A' ' 616' ' ' ALA . 16.7 p -96.77 27.49 3.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 88.5 p -168.65 -40.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.333 179.985 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -115.99 153.33 31.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.237 -179.651 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.44 HG21 ' HB ' ' A' ' 611' ' ' ILE . 19.4 tt -144.78 149.11 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.912 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 71.2 m -128.36 111.61 13.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.548 ' O ' ' HA ' ' A' ' 608' ' ' THR . 91.9 mt -100.45 141.46 33.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.102 -179.793 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 579' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 607' ' ' THR . 22.6 t -124.8 140.43 52.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.394 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.459 ' HB3' HD12 ' A' ' 566' ' ' LEU . 48.3 p90 -154.55 169.79 22.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.11 -179.568 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.4 m -84.55 122.38 28.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.862 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.17 160.49 3.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.147 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.2 m -56.72 158.91 4.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 32.2 p -96.97 12.79 31.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.573 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . 0.409 ' CG ' ' N ' ' A' ' 586' ' ' ASN . 5.8 p-10 -105.78 -57.98 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.143 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.409 ' N ' ' CG ' ' A' ' 585' ' ' ASP . 0.1 OUTLIER 48.98 24.13 0.82 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.783 0.325 . . . . 0.0 111.364 179.914 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.5 m -98.31 -2.86 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.052 0.453 . . . . 0.0 110.995 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -165.0 -8.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.844 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.431 HG21 ' OD1' ' A' ' 628' ' ' ASP . 16.4 t -65.27 128.75 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.866 0.365 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 590' ' ' THR . . . . . 0.47 ' H ' HG22 ' A' ' 590' ' ' THR . 0.1 OUTLIER -116.78 -30.5 5.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.277 -179.839 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.671 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -161.67 174.26 38.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.729 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -125.98 125.79 43.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.867 0.365 . . . . 0.0 110.905 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.45 ' OD1' HG23 ' A' ' 603' ' ' THR . 2.3 m-20 -100.03 119.11 37.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.6 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.83 135.41 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.006 0.432 . . . . 0.0 111.185 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.676 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.2 m-85 -99.88 129.71 45.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.982 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -109.93 89.16 2.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.586 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 68.45 72.34 0.83 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 27.0 p 46.66 30.04 1.07 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.952 0.406 . . . . 0.0 111.334 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.07 106.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.763 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.676 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 7.7 tt -47.1 138.81 6.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.449 -179.641 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -114.39 -92.11 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.0 179.816 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.6 t -90.69 168.01 12.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.256 0.551 . . . . 0.0 111.676 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 603' ' ' THR . . . . . 0.45 HG23 ' OD1' ' A' ' 593' ' ' ASP . 43.5 m -138.61 108.5 6.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.348 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 13.3 m -105.86 -168.17 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.351 -179.28 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.671 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.4 p -143.06 -12.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.82 -135.49 8.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.549 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 607' ' ' THR . . . . . 0.436 ' O ' ' HA ' ' A' ' 579' ' ' SER . 70.2 p -111.3 5.13 19.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.775 0.321 . . . . 0.0 111.238 -179.896 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.548 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 2.3 p -115.38 164.14 14.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -150.93 115.85 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.733 0.301 . . . . 0.0 111.11 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.6 m -102.56 121.37 42.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.154 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -120.7 121.77 66.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 -179.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 80.2 p -101.01 174.6 5.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.774 179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.89 58.38 10.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.362 -179.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.1 OUTLIER -120.21 133.36 55.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.861 0.362 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -74.58 160.91 30.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.232 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.5 ' HB1' HG23 ' A' ' 573' ' ' THR . . . -90.11 147.01 23.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.002 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 52.97 52.95 12.84 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.1 m -134.34 142.4 47.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.175 -179.791 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.8 t -79.72 137.44 37.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.45 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -139.17 134.61 33.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.476 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -115.84 113.48 23.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.043 179.119 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . 0.471 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 63.1 m-85 -108.14 160.77 15.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.355 0.598 . . . . 0.0 112.372 -178.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.86 130.36 8.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.834 179.557 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.418 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -99.61 152.03 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.168 0.509 . . . . 0.0 111.724 -179.242 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.597 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 11.6 mttt -140.73 142.3 34.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.986 -179.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -102.19 122.92 45.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.127 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HD3' ' OD2' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -114.35 149.88 35.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 179.825 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . 0.431 ' OD1' HG21 ' A' ' 589' ' ' VAL . 95.5 m-20 -105.76 -179.17 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 -179.864 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.2 37.14 0.89 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.864 179.77 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -144.23 6.3 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.62 16.45 70.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.457 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.49 111.59 24.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.746 0.308 . . . . 0.0 110.789 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 633' ' ' VAL . 10.6 p -110.34 144.38 18.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.242 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.43 ' HG ' ' N ' ' A' ' 562' ' ' ALA . 0.1 OUTLIER -78.9 -162.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.012 -179.874 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.489 ' O ' ' HB3' ' A' ' 562' ' ' ALA . . . -81.84 178.39 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.103 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.489 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -90.33 147.45 23.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.294 -179.818 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 8.2 t -78.61 -177.11 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.755 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.09 142.71 58.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.535 179.682 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.93 120.01 23.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.955 -179.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.471 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.5 p -100.26 126.88 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.186 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.32 93.17 4.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.479 179.801 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 15.5 m -99.72 155.45 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.238 -179.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.26 118.15 33.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.768 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.081 179.945 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.561 0.219 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.9 175.85 2.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.44 2.093 . . . . 0.0 112.243 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 27.1 m -83.3 135.35 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.285 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.23 127.16 92.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.586 -179.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.419 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 60.4 Cg_exo -51.45 162.01 1.65 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.831 2.354 . . . . 0.0 111.838 179.261 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 8.1 t -159.56 169.41 23.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.279 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 57.82 33.79 23.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.348 179.653 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.703 HD11 ' HG ' ' A' ' 578' ' ' LEU . 53.9 tp -60.51 158.73 11.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.316 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.464 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -161.5 173.42 14.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.406 . . . . 0.0 111.553 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.9 p -129.43 127.48 41.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.372 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.57 -84.18 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.722 -179.53 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.71 97.0 9.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.44 -179.591 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.443 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.5 OUTLIER -118.63 106.41 12.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.718 179.703 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 39.3 p -95.65 -156.63 0.53 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.025 179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.2 p -99.34 24.15 8.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.453 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 87.4 p -163.95 -42.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.135 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.502 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.7 OUTLIER -119.04 128.63 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.256 -179.661 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 610' ' ' THR . 11.4 tt -119.06 146.47 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 34.6 m -112.19 131.56 55.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.594 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.703 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -117.9 146.75 43.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.267 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 579' ' ' SER . . . . . 0.454 ' O ' HD12 ' A' ' 566' ' ' LEU . 12.5 t -140.91 140.2 34.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.471 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.419 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 40.2 p90 -155.55 169.77 23.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.256 -179.596 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.9 126.17 32.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.119 179.905 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.77 5.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.157 -179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -72.62 157.49 37.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.945 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.7 -2.84 58.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -123.18 54.39 1.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . 0.517 HD21 ' HB ' ' A' ' 589' ' ' VAL . 17.6 t-20 -74.33 1.5 11.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.947 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.63 -14.58 9.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.318 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -135.32 -20.04 0.74 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.666 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.517 ' HB ' HD21 ' A' ' 586' ' ' ASN . 23.1 t -56.71 148.42 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.676 0.274 . . . . 0.0 110.984 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 19.6 p -130.59 -22.49 2.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.822 -179.565 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.64 179.09 40.17 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.041 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . 0.412 ' CD2' ' HA ' ' A' ' 626' ' ' ALA . 85.9 m-85 -137.12 123.52 20.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.633 0.254 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -99.65 128.55 45.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.443 179.467 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.407 HG13 ' CB ' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -103.4 131.65 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.854 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.548 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 95.8 m-85 -99.43 150.44 22.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.651 -179.722 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -134.05 93.53 3.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.653 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.25 73.79 0.39 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.328 -179.676 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.6 p 47.97 35.93 5.62 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.875 0.369 . . . . 0.0 111.405 -179.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.98 104.59 1.53 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.122 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 2.0 tt -49.54 121.23 4.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.063 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . 0.466 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -88.2 -101.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.199 179.892 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.466 ' H ' ' HB2' ' A' ' 601' ' ' ALA . 4.5 t -90.67 169.95 10.56 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.18 0.514 . . . . 0.0 111.574 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.77 113.94 12.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.362 179.761 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.511 HG12 ' HA ' ' A' ' 609' ' ' ALA . 9.9 m -113.71 -175.17 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.621 -179.172 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.521 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -145.26 7.6 1.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.807 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.38 -120.68 3.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.649 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.49 -14.53 7.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.69 0.281 . . . . 0.0 111.338 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.503 ' O ' HG21 ' A' ' 604' ' ' VAL . 67.6 p -114.09 175.02 5.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.511 ' HA ' HG12 ' A' ' 604' ' ' VAL . . . -157.76 126.18 5.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.6 OUTLIER -111.47 133.48 53.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.907 0.384 . . . . 0.0 111.46 -179.66 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.4 mp -114.82 135.13 55.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -102.8 178.5 4.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 72.78 -84.75 0.56 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.427 -179.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 5.0 mt 49.58 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 120.9 0.381 . . . . 0.0 111.625 179.348 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . 0.504 ' N ' ' HH ' ' A' ' 620' ' ' TYR . . . -168.31 111.27 0.59 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.83 179.938 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . 0.446 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -60.4 168.76 1.95 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.493 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.73 28.5 17.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.284 179.821 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.44 148.21 40.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.335 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.49 135.0 33.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.452 179.547 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . 0.504 ' HH ' ' N ' ' A' ' 615' ' ' ALA . 57.6 m-85 -126.54 146.68 50.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.24 0.543 . . . . 0.0 111.981 -179.474 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.15 103.28 6.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -99.47 165.07 11.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.359 0.6 . . . . 0.0 112.031 -178.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.6 p -151.96 162.9 40.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 179.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.409 HG21 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -125.92 153.6 34.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.953 0.406 . . . . 0.0 111.548 -179.8 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.548 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.7 mmtt -140.36 124.63 17.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.047 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 592' ' ' TYR . . . -82.8 100.62 10.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.559 179.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.401 ' O ' HG12 ' A' ' 589' ' ' VAL . 0.6 OUTLIER -99.72 155.08 17.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.012 0.434 . . . . 0.0 111.163 -179.547 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.67 -156.7 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.211 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -49.56 -78.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.647 0.261 . . . . 0.0 111.263 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -161.06 48.35 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.517 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -169.62 9.25 0.05 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.755 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -152.43 131.41 12.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.262 0.531 . . . . 0.0 111.254 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.43 124.47 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.735 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.413 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 93.0 p -67.81 -164.55 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.935 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.44 169.72 10.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.994 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.4 137.7 32.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.888 179.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.7 p -73.56 -167.53 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.08 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -70.89 166.95 20.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.96 131.97 40.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.329 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.21 110.76 33.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.218 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.73 118.5 28.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.85 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.19 127.46 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -90.03 106.48 18.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 644' ' ' THR . . . . . 0.446 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 29.8 p . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.219 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 559' ' ' ALA . . . . . 0.559 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.662 0.268 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -86.73 -172.31 0.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.212 2.608 . . . . 0.0 112.271 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.74 134.02 36.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.189 179.967 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 562' ' ' ALA . . . . . 0.439 ' HB2' ' N ' ' A' ' 635' ' ' ALA . . . -71.17 132.45 86.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 563' ' ' PRO . . . . . 0.499 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.9 Cg_exo -47.61 162.75 0.22 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.666 2.244 . . . . 0.0 112.214 179.64 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.7 t -156.11 161.86 40.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.37 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.2 m120 58.66 49.3 10.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.472 179.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.764 HD11 ' HG ' ' A' ' 578' ' ' LEU . 21.7 tp -75.19 158.27 33.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.376 179.479 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 567' ' ' ALA . . . . . 0.541 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.52 178.05 9.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.924 0.393 . . . . 0.0 111.448 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.12 129.51 48.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.22 179.442 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.7 p -103.34 -88.88 0.4 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.631 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 570' ' ' ALA . . . . . 0.638 ' HB3' ' HG1' ' A' ' 577' ' ' THR . . . -90.21 100.84 13.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.776 0.322 . . . . 0.0 111.33 -179.583 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 571' ' ' GLN . . . . . 0.659 ' HB2' HG13 ' A' ' 576' ' ' ILE . 4.0 tm0? -121.94 129.11 52.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.409 ' HG1' ' H ' ' A' ' 575' ' ' SER . 5.4 p -115.04 -161.52 0.78 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.766 179.69 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 47.5 p -91.55 11.89 22.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.745 0.307 . . . . 0.0 111.425 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 574' ' ' SER . . . . . 0.504 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 52.2 p -145.05 -43.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.409 ' H ' ' HG1' ' A' ' 572' ' ' THR . 0.1 OUTLIER -112.14 172.46 6.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.583 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.659 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.8 tt -160.27 139.59 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.379 . . . . 0.0 111.3 179.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 577' ' ' THR . . . . . 0.638 ' HG1' ' HB3' ' A' ' 570' ' ' ALA . 15.1 m -108.13 131.26 54.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.702 179.755 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . 0.764 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -114.24 157.04 23.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.652 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 p -152.28 137.12 17.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.488 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 580' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 37.3 p90 -156.8 169.71 24.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.961 0.41 . . . . 0.0 111.371 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.9 m -81.18 135.69 35.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.136 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.02 172.45 2.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 67.8 p -83.44 9.62 10.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.38 24.68 5.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.231 179.943 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -142.75 45.79 1.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.779 179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -62.6 -5.55 2.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.261 -179.836 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 5.6 p -76.02 4.19 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.14 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -150.41 -19.8 0.07 OUTLIER Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.881 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 589' ' ' VAL . . . . . 0.403 HG11 ' O ' ' A' ' 627' ' ' LYS . 6.0 t -78.93 136.7 23.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 41.4 p -106.84 -7.49 17.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.243 -179.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 591' ' ' GLY . . . . . 0.649 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 167.15 -179.86 40.56 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.67 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.01 128.87 39.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 593' ' ' ASP . . . . . 0.513 ' HB3' HD21 ' A' ' 600' ' ' LEU . 0.7 OUTLIER -103.25 116.76 33.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.809 179.934 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 594' ' ' VAL . . . . . 0.463 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -101.99 136.7 32.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 595' ' ' TYR . . . . . 0.44 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 47.7 m-85 -99.4 168.48 9.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.135 -179.657 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -133.05 84.75 2.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.151 179.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.56 -59.86 3.67 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.093 -179.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.84 -16.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 179.861 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -110.35 136.75 49.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 600' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.3 tm? -55.45 125.44 20.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.826 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -95.82 -104.87 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.372 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 602' ' ' THR . . . . . 0.564 HG21 HG13 ' A' ' 611' ' ' ILE . 9.0 t -90.54 165.39 13.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.271 0.558 . . . . 0.0 111.936 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 57.8 m -129.92 128.36 42.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.003 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 604' ' ' VAL . . . . . 0.588 HG13 ' HA ' ' A' ' 609' ' ' ALA . 11.7 m -127.8 -177.93 2.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.839 0.352 . . . . 0.0 111.713 -179.364 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 605' ' ' THR . . . . . 0.649 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 72.1 p -137.87 2.04 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.878 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -117.09 -123.11 3.38 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.424 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 2.0 p -130.6 8.78 4.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.681 0.277 . . . . 0.0 111.165 179.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 608' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 40.6 p -130.19 126.18 36.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.266 -179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 609' ' ' ALA . . . . . 0.588 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -114.51 126.1 54.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.247 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 610' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.6 m -111.8 123.67 50.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 611' ' ' ILE . . . . . 0.564 HG13 HG21 ' A' ' 602' ' ' THR . 4.5 mp -106.56 138.68 30.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.086 -179.982 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.02 163.46 15.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.823 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 67.97 68.43 1.65 Allowed Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.436 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 614' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -123.05 152.5 40.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -97.53 155.07 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.996 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.52 161.89 15.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 55.54 38.91 30.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.008 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.13 141.45 36.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.114 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 89.9 p -87.7 131.26 34.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.721 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.366 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 621' ' ' THR . . . . . 0.522 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -106.42 118.56 36.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.29 179.249 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -111.34 165.11 12.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.21 0.529 . . . . 0.0 112.004 -179.151 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 623' ' ' THR . . . . . 0.484 HG22 ' HA ' ' A' ' 639' ' ' ALA . 0.8 OUTLIER -155.91 136.53 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.888 179.514 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 624' ' ' VAL . . . . . 0.463 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -100.58 151.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 111.755 -179.297 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.7 mttt -139.81 157.65 45.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.704 -179.725 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . 0.505 ' H ' ' HG ' ' A' ' 634' ' ' SER . . . -109.22 145.2 36.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.201 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 627' ' ' LYS . . . . . 0.403 ' O ' HG11 ' A' ' 589' ' ' VAL . 0.0 OUTLIER -140.11 131.36 26.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.764 179.845 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.46 169.81 8.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.981 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.57 37.01 0.85 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.022 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -134.98 18.51 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.967 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 68.34 32.21 75.4 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.588 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 632' ' ' ASN . . . . . 0.559 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 47.5 m-20 -127.57 125.12 39.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.713 0.292 . . . . 0.0 110.915 -179.9 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -119.77 134.93 61.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.885 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 634' ' ' SER . . . . . 0.505 ' HG ' ' H ' ' A' ' 626' ' ' ALA . 60.2 p -71.56 -170.51 0.54 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.121 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 635' ' ' ALA . . . . . 0.439 ' N ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.7 173.72 8.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.596 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 636' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.64 134.43 34.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.971 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.3 t -73.06 -172.21 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.15 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 149.38 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.484 ' HA ' HG22 ' A' ' 623' ' ' THR . . . -84.24 128.0 34.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.197 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 640' ' ' VAL . . . . . 0.522 ' O ' ' HA ' ' A' ' 621' ' ' THR . 12.2 p -103.23 135.87 38.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -106.99 120.1 41.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.93 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.588 HG22 ' HG3' ' A' ' 571' ' ' GLN . 0.7 OUTLIER -122.92 127.27 74.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.95 179.957 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -96.68 103.52 15.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.184 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.892 0.377 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.26 -61.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.995 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -58.02 142.67 79.46 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.214 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.49 -177.55 2.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.538 2.159 . . . . 0.0 112.436 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 69.5 p -91.98 155.78 17.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.105 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.605 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -83.08 127.03 70.86 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.426 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.3 Cg_exo -48.34 138.42 23.55 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.542 2.161 . . . . 0.0 111.683 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 52.5 p -128.28 162.47 26.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.524 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 59.38 54.38 4.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.598 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.763 HD13 ' HG ' ' A' ' 578' ' ' LEU . 65.5 tp -69.68 160.78 30.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -160.88 176.05 11.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.996 0.426 . . . . 0.0 111.581 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 70.8 p -136.52 122.81 20.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.461 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 7.0 p -99.42 -88.04 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.19 131.5 34.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.075 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.472 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -150.49 113.65 4.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.825 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.8 p -95.84 -153.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.99 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.2 p -97.62 22.41 9.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.488 ' O ' HD13 ' A' ' 614' ' ' LEU . 86.9 p -166.15 -46.51 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.502 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.34 133.59 50.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.213 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.472 HG13 ' HB2' ' A' ' 571' ' ' GLN . 21.5 tt -124.33 153.17 30.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.043 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.7 m -122.95 121.68 36.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.763 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -105.72 149.47 26.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.452 -179.307 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.83 143.83 41.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.112 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.518 ' HB3' HD11 ' A' ' 566' ' ' LEU . 47.6 p90 -158.55 169.98 23.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.924 0.392 . . . . 0.0 111.483 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.93 128.88 33.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.26 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . 0.511 ' HA ' ' HH ' ' A' ' 592' ' ' TYR . . . -63.99 155.09 32.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.05 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 16.4 m -65.07 142.34 58.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.91 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 6.8 m -64.44 -17.49 63.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.047 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -112.75 143.57 43.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.957 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -152.33 42.55 0.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -17.47 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.186 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -152.32 -4.0 0.16 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.551 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 12.1 t -64.57 149.44 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.755 0.312 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 39.7 p -124.3 -51.5 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.417 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -153.86 -171.91 21.4 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.904 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.511 ' HH ' ' HA ' ' A' ' 582' ' ' ALA . 87.4 m-85 -121.52 175.7 6.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.855 0.36 . . . . 0.0 110.975 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.453 ' HB3' HD23 ' A' ' 600' ' ' LEU . 3.6 m-20 -140.21 131.92 27.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.677 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.52 ' HB ' HG22 ' A' ' 602' ' ' THR . 43.1 t -99.9 126.23 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.205 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.428 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 41.3 m-85 -99.97 129.47 46.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -106.55 84.77 2.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.542 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.91 -86.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.341 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -143.63 11.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.912 0.387 . . . . 0.0 111.054 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -137.0 151.1 48.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.09 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -60.32 136.02 57.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.428 ' H ' HD21 ' A' ' 600' ' ' LEU . . . -113.06 -101.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.497 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.52 HG22 ' HB ' ' A' ' 594' ' ' VAL . 12.2 t -88.85 176.93 6.84 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.789 0.328 . . . . 0.0 111.425 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -140.58 140.03 35.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.931 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.459 HG13 ' HA ' ' A' ' 609' ' ' ALA . 2.9 m -140.39 177.48 4.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.496 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.417 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 1.4 p -144.57 3.26 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.018 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.63 -132.02 6.1 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 4.71 13.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.689 0.28 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 36.8 p -129.89 -178.98 4.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.459 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -153.78 147.8 25.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.996 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.3 m -127.76 122.43 32.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . . . . . . . . . 3.5 mt -121.68 118.11 54.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.976 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -102.84 175.24 5.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.866 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.58 70.76 0.99 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.498 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 574' ' ' SER . 8.5 mt -136.93 122.46 19.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.762 0.315 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -73.37 143.92 46.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.29 161.4 29.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.384 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.73 44.31 26.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.283 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.1 m -140.12 152.43 46.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.321 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.2 t -89.24 134.03 34.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -137.78 122.82 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.257 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 64.0 p -103.1 124.22 48.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -119.21 162.38 18.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.104 0.478 . . . . 0.0 111.732 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.45 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 0.8 OUTLIER -155.35 179.49 9.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.258 179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.486 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -138.54 147.26 25.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.004 0.43 . . . . 0.0 111.596 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.485 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 3.2 mmtp -141.02 120.21 12.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.38 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.547 ' HB2' ' HG ' ' A' ' 634' ' ' SER . . . -80.13 138.45 36.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.634 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HG2' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -124.77 161.93 25.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.881 0.372 . . . . 0.0 111.312 -179.725 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER -123.7 155.31 38.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.661 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.34 51.66 2.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.189 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.13 3.22 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.172 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 92.28 42.87 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.55 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.45 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . 5.4 m120 -134.28 119.47 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.788 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.37 148.3 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 0.0 111.34 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.547 ' HG ' ' HB2' ' A' ' 626' ' ' ALA . 13.3 p -90.25 -165.94 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.605 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -90.29 176.18 6.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.714 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.485 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -89.96 146.76 24.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.044 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 6.6 p -81.15 -174.02 4.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.884 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.17 146.64 54.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.555 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 123.17 27.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.489 ' CG2' HD21 ' A' ' 566' ' ' LEU . 4.9 m -100.79 106.88 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.98 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.55 95.03 8.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.955 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.428 ' H ' HG23 ' A' ' 642' ' ' VAL . 0.0 OUTLIER -106.38 136.36 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.081 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.33 114.54 28.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.79 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.201 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.91 0.386 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.69 69.43 10.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.549 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -64.64 152.57 89.54 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.76 -159.86 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.668 2.245 . . . . 0.0 112.467 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 138.94 50.41 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.104 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -70.98 132.3 86.73 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.23 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.435 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.2 Cg_exo -45.75 155.91 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.77 2.313 . . . . 0.0 112.116 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 70.2 p -136.52 149.96 48.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.997 0.427 . . . . 0.0 111.742 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 59.36 65.01 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.004 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.791 HD13 ' HG ' ' A' ' 578' ' ' LEU . 1.1 tp -88.48 152.64 21.75 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.627 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -178.77 6.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.952 0.406 . . . . 0.0 111.341 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.36 127.38 39.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.309 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.82 -86.16 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.326 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.46 97.94 10.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.547 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -117.54 109.83 17.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.505 ' HG1' ' H ' ' A' ' 575' ' ' SER . 53.6 p -90.32 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 34.4 p -89.76 5.52 45.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.412 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 20.2 p -140.35 -48.1 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.505 ' H ' ' HG1' ' A' ' 572' ' ' THR . 0.0 OUTLIER -106.91 165.05 11.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.74 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.547 HG13 ' HB2' ' A' ' 571' ' ' GLN . 20.3 tt -150.55 146.23 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.359 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 85.0 m -109.17 123.65 49.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.791 ' HG ' HD13 ' A' ' 566' ' ' LEU . 1.1 tp -111.43 131.24 55.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.7 t -127.05 137.55 53.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.382 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.466 ' HB3' HD11 ' A' ' 566' ' ' LEU . 45.6 p90 -154.52 169.74 23.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.143 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.1 m -88.01 129.43 35.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.994 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.74 165.09 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.9 166.57 13.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.033 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -1.4 53.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.836 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -117.95 64.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.437 ' C ' ' H ' ' A' ' 588' ' ' GLY . 34.4 t30 -70.9 -153.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.611 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' A' ' 586' ' ' ASN . 47.3 t 74.98 -37.74 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -108.98 -28.09 4.59 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.854 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.8 t -68.87 124.26 24.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.607 0.241 . . . . 0.0 110.585 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 18.4 p -123.38 1.15 8.99 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.746 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.18 168.72 40.67 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.193 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -131.08 162.21 30.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.787 0.327 . . . . 0.0 110.602 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.45 ' OD1' HG21 ' A' ' 603' ' ' THR . 48.2 m-20 -126.83 135.44 51.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.868 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 47.2 t -100.15 129.07 51.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.25 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.441 ' CE2' ' HG3' ' A' ' 625' ' ' LYS . 33.7 m-85 -107.29 129.63 54.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.723 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -123.91 94.23 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 60.11 72.05 0.68 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.507 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 8.2 p 46.12 34.48 2.11 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.907 0.384 . . . . 0.0 111.356 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.51 107.9 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.759 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 3.9 tt -52.36 122.83 9.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.078 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.458 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -91.81 -95.27 0.13 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.247 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.458 ' H ' ' HB2' ' A' ' 601' ' ' ALA . 7.6 t -90.73 177.01 6.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.104 0.478 . . . . 0.0 111.79 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.45 HG21 ' OD1' ' A' ' 593' ' ' ASP . 7.5 m -140.61 134.17 30.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.545 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 11.4 m -136.67 -173.45 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.956 0.408 . . . . 0.0 111.589 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.746 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.6 p -131.81 -25.32 2.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.999 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -92.98 -151.19 27.64 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.484 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 17.7 p -100.41 12.94 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.843 0.354 . . . . 0.0 111.209 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.91 155.43 45.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.988 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.424 ' HB1' ' CH2' ' A' ' 580' ' ' TRP . . . -144.79 155.18 43.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.67 113.99 11.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.3 mp -99.78 113.84 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.671 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 13.3 p -101.94 132.26 47.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.913 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.48 1.34 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.491 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.7 mt -137.0 114.35 10.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.768 0.318 . . . . 0.0 110.693 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -67.33 128.49 36.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -64.1 175.14 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.271 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 25.7 t70 57.09 30.39 18.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.07 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.4 m -140.18 144.74 36.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.45 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.87 134.45 33.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.396 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -127.8 139.32 52.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 111.443 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.1 p -117.96 117.9 30.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.11 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.436 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 68.2 m-85 -106.68 171.31 7.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.328 0.585 . . . . 0.0 112.164 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.91 173.67 8.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.102 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.442 HG22 HD12 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -139.68 150.14 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.981 0.419 . . . . 0.0 111.448 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 634' ' ' SER . 7.6 mttt -140.54 123.46 16.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.203 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.418 ' O ' HG22 ' A' ' 633' ' ' VAL . . . -81.03 134.85 35.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.308 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -131.63 149.9 52.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.831 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -111.73 -179.6 3.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.12 43.07 1.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.041 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.52 5.27 0.61 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.208 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 86.95 9.27 74.36 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.462 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.549 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.7 m-80 -93.43 116.95 29.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 626' ' ' ALA . 5.9 p -125.06 135.38 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.445 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.56 -160.34 0.15 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.993 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.48 -177.08 4.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.045 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -89.93 136.77 32.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.15 -174.27 1.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.778 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.31 142.64 42.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -88.13 126.19 34.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.097 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.638 HG12 HD21 ' A' ' 566' ' ' LEU . 10.2 p -101.02 124.86 54.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 3.4 p -95.96 89.85 5.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.867 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.56 132.27 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.61 133.66 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 111.126 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.088 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 53.9 m80 . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.75 0.309 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.27 -13.4 16.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.007 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -68.37 146.93 98.15 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.198 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.5 ' HB2' ' H ' ' A' ' 561' ' ' THR . 83.7 Cg_endo -79.11 -139.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.721 2.281 . . . . 0.0 112.456 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.5 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -114.22 134.78 54.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.864 0.364 . . . . 0.0 111.048 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.599 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -78.46 130.11 72.47 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.455 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.419 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 52.0 Cg_exo -54.23 171.57 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.68 2.253 . . . . 0.0 112.042 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.8 t -163.6 164.25 24.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.28 34.62 24.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.3 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.769 HD13 ' HG ' ' A' ' 578' ' ' LEU . 35.8 tp -60.92 158.83 12.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.468 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.63 -177.54 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.263 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' SER . . . . . 0.569 ' HG ' ' HG2' ' A' ' 571' ' ' GLN . 5.3 t -144.89 126.97 15.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.066 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 17.8 p -99.78 -81.02 0.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.545 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -83.3 104.28 13.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.584 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.569 ' HG2' ' HG ' ' A' ' 568' ' ' SER . 0.0 OUTLIER -120.17 89.85 3.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.459 179.457 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 79.5 p -80.96 -158.8 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 63.1 p -94.57 22.86 5.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.61 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.479 ' O ' HD12 ' A' ' 614' ' ' LEU . 2.9 p -168.74 -44.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.706 0.288 . . . . 0.0 111.458 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.402 ' HB3' ' HG ' ' A' ' 612' ' ' SER . 0.3 OUTLIER -106.25 138.78 41.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -179.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.537 HD13 HG12 ' A' ' 642' ' ' VAL . 9.5 tt -130.26 148.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -116.29 109.8 17.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.769 ' HG ' HD13 ' A' ' 566' ' ' LEU . 1.3 tp -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.899 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' SER . . . . . 0.433 ' O ' HD11 ' A' ' 566' ' ' LEU . 34.8 t -130.82 139.97 50.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.667 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.419 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 40.2 p90 -151.84 170.07 20.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 0.0 111.255 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.5 m -79.96 135.35 36.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.057 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.51 173.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 p -76.56 155.6 33.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.852 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 71.3 p -91.45 18.21 7.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -126.46 -69.34 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 55.11 30.81 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.031 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.52 -12.09 9.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.021 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -156.63 -4.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.428 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.8 t -62.58 133.2 28.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.7 0.286 . . . . 0.0 111.179 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.485 HG22 ' HE3' ' A' ' 627' ' ' LYS . 1.3 t -112.47 -24.05 9.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.175 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -170.96 -177.85 41.13 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.665 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -126.66 133.66 50.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.833 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.27 117.43 34.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.502 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.586 HG11 HG21 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.38 132.66 44.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.902 0.382 . . . . 0.0 111.067 -179.719 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -99.43 170.38 8.66 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.036 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -140.23 85.6 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.319 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.18 -67.38 2.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.984 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -155.5 -9.04 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.824 0.345 . . . . 0.0 110.998 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.12 132.96 55.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.351 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -98.65 -105.67 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.87 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.586 HG21 HG11 ' A' ' 594' ' ' VAL . 3.9 t -90.77 173.18 8.15 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.962 0.411 . . . . 0.0 111.497 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 4.9 m -139.09 126.97 22.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.654 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.457 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 13.9 m -126.45 -169.1 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.368 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.53 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 7.2 p -137.36 2.01 2.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.208 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -126.3 -147.47 6.85 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.424 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 81.5 p -105.12 25.92 9.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.347 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.573 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.6 OUTLIER -146.5 127.31 14.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.096 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.457 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -119.93 140.36 51.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.157 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -116.85 115.05 24.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.506 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.9 mt -114.12 110.46 32.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.189 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 612' ' ' SER . . . . . 0.402 ' HG ' ' HB3' ' A' ' 575' ' ' SER . 0.5 OUTLIER -112.5 158.52 19.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.769 179.787 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.48 29.59 9.3 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.617 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 574' ' ' SER . 6.0 mt -91.4 -173.91 3.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.764 0.316 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -123.18 120.31 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.06 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -57.9 159.78 5.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.94 37.39 28.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.165 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.4 m -140.13 146.54 38.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.255 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 28.1 t -89.47 139.34 30.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.638 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -140.15 125.35 18.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 111.254 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.44 123.87 46.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.519 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -115.66 169.08 9.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.244 0.545 . . . . 0.0 111.829 -179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -159.28 159.62 34.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.59 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.767 HG23 HD21 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -121.12 148.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.132 0.491 . . . . 0.0 111.948 -179.508 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 8.3 mttt -140.35 157.89 44.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.688 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.68 141.24 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.413 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.485 ' HE3' HG22 ' A' ' 590' ' ' THR . 0.0 OUTLIER -131.16 153.71 49.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.784 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.51 174.78 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.942 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.65 56.3 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.85 -42.31 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.178 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.79 2.95 1.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.472 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -86.81 144.89 26.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 110.849 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 9.8 m -136.03 148.89 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.366 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.6 OUTLIER -87.18 -161.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.788 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.599 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.06 169.46 11.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 111.012 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.97 140.25 30.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.426 ' HB3' HG21 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -78.84 -173.5 3.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.447 ' ND2' ' HB3' ' A' ' 566' ' ' LEU . 0.9 OUTLIER -60.28 155.07 18.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.83 154.08 27.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.096 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -136.93 109.12 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.108 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.52 111.16 22.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.706 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.537 HG12 HD13 ' A' ' 576' ' ' ILE . 0.9 OUTLIER -112.55 152.41 14.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.989 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -113.98 106.5 14.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.021 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.776 0.322 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 5.7 mmm -100.04 -80.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -74.3 145.18 82.53 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 634' ' ' SER . 74.4 Cg_endo -73.52 -148.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 583' ' ' SER . 0.1 OUTLIER -119.0 128.25 54.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.934 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.13 128.73 91.34 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.246 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.431 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 80.3 Cg_exo -45.16 145.67 3.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.698 2.266 . . . . 0.0 112.086 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 32.8 p -127.82 156.16 42.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.37 . . . . 0.0 111.685 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.08 60.75 3.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.71 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' A' ' 580' ' ' TRP . 13.0 tp -79.29 158.29 27.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.57 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.69 175.07 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 0.0 111.673 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 13.7 p -127.03 128.94 47.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.267 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.5 p -99.57 -84.55 0.41 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.359 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.36 148.89 25.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.368 . . . . 0.0 111.167 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 136.78 8.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.732 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.474 ' HG1' ' H ' ' A' ' 575' ' ' SER . 31.9 p -134.22 -155.3 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.12 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.423 ' H ' ' HB ' ' A' ' 572' ' ' THR . 0.0 OUTLIER -95.28 20.73 8.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.301 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 12.9 p -167.06 -41.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.51 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.486 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -109.75 155.85 21.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.275 -179.45 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.584 HG22 ' HB ' ' A' ' 611' ' ' ILE . 15.0 tt -159.26 134.98 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 111.242 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 55.6 m -104.46 141.7 35.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.962 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.44 ' O ' ' HA ' ' A' ' 608' ' ' THR . 54.6 mt -123.7 146.06 48.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 51.9 p -133.39 127.16 32.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.733 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.586 ' HB3' HD11 ' A' ' 566' ' ' LEU . 46.8 p90 -137.21 169.6 17.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.172 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.7 m -87.12 138.09 31.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.129 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.76 166.5 2.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.222 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.567 ' HB2' HG22 ' A' ' 561' ' ' THR . 34.9 p -73.61 -3.67 29.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.928 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 59.34 16.29 4.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.077 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -148.27 68.18 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.592 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.0 25.24 0.58 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.196 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.01 -19.27 21.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.985 0.422 . . . . 0.0 110.661 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -149.69 -14.81 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.242 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.439 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 17.3 t -66.02 144.29 14.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.778 0.323 . . . . 0.0 111.065 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.571 HG23 ' HB3' ' A' ' 629' ' ' ALA . 75.4 p -123.74 -48.7 1.9 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.281 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.581 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -140.44 -174.68 14.04 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.787 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -133.81 154.84 50.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.683 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -121.73 137.71 54.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.952 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.506 ' HB ' HG22 ' A' ' 602' ' ' THR . 56.1 t -104.19 128.42 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.755 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.556 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 40.7 m-85 -102.2 126.84 49.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.305 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -99.02 84.32 3.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.225 179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 82.84 -72.53 2.82 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.226 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 17.2 p -147.45 3.41 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.663 0.268 . . . . 0.0 111.265 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -121.75 173.96 7.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.453 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -90.3 119.15 30.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.638 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.409 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -92.83 -104.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.364 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.506 HG22 ' HB ' ' A' ' 594' ' ' VAL . 15.1 t -90.64 173.49 8.02 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 111.616 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 3.1 m -139.52 119.76 13.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.511 HG13 ' HA ' ' A' ' 609' ' ' ALA . 12.7 m -122.41 -172.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.506 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.581 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 27.7 p -141.6 -10.04 0.93 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.098 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -102.07 -123.8 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.61 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 26.3 p -122.12 -13.12 8.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.713 0.292 . . . . 0.0 111.245 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 27.3 p -105.58 172.74 6.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.081 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.511 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -152.74 155.14 36.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.187 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -129.95 117.17 19.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.209 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.584 ' HB ' HG22 ' A' ' 576' ' ' ILE . 5.7 mt -115.84 109.82 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.013 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.8 m -107.66 155.37 20.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.839 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 90.65 54.52 2.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.538 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.9 mt -118.82 144.16 46.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.88 0.372 . . . . 0.0 110.937 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -94.91 137.91 33.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.028 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -68.11 162.08 25.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.422 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 55.51 43.3 28.74 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.307 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 618' ' ' THR . . . . . 0.432 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 5.6 m -140.65 146.56 38.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.34 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.6 t -91.16 120.38 32.05 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.527 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . 0.432 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 74.8 m-85 -121.63 129.32 52.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.957 0.408 . . . . 0.0 111.524 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 64.0 p -104.33 141.02 37.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.92 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.629 ' H ' HG12 ' A' ' 640' ' ' VAL . 32.1 m-85 -129.31 169.05 15.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.274 0.559 . . . . 0.0 112.09 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.85 168.18 16.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.057 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.456 HG22 HD11 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -137.8 153.45 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.065 0.46 . . . . 0.0 111.56 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.556 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 1.4 mttp -140.41 149.95 43.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.92 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -105.18 136.92 43.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.88 149.77 50.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.116 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.439 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 1.8 m-20 -107.14 167.36 9.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.651 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . 0.571 ' HB3' HG23 ' A' ' 590' ' ' THR . . . -78.25 -8.92 58.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.149 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -92.56 -9.99 39.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 97.27 54.28 1.28 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.71 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.93 131.68 31.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.779 0.323 . . . . 0.0 110.975 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 24.9 t -126.32 132.79 70.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.253 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.561 ' HB2' ' HG2' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -79.28 -157.48 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 179.656 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -89.34 177.23 6.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.872 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.458 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -86.26 143.51 27.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -73.24 -170.13 0.73 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.35 146.87 42.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.632 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.06 134.33 36.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.219 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.629 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -99.78 154.43 4.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.935 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.03 81.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.434 ' H ' HG11 ' A' ' 642' ' ' VAL . 3.3 p -100.04 132.31 45.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.898 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -105.54 111.92 24.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.244 179.976 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 25.8 p80 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.827 0.346 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -107.13 -156.37 0.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.865 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -55.36 155.15 10.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.148 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.445 ' HG2' ' HB3' ' A' ' 634' ' ' SER . 40.2 Cg_endo -65.95 173.97 6.37 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.481 2.121 . . . . 0.0 112.236 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 1.4 p -84.97 127.43 34.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.049 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.622 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -63.86 127.28 91.45 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.042 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -46.18 133.61 15.22 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.657 2.238 . . . . 0.0 112.039 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 27.7 p -117.15 153.4 32.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.658 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 58.95 77.35 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.773 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.794 HD11 ' HG ' ' A' ' 578' ' ' LEU . 24.6 tp -83.7 162.4 20.73 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.546 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -159.22 167.31 29.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.0 111.672 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 80.2 p -128.71 136.37 50.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.53 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -112.07 -88.13 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.504 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.96 108.69 19.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.451 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.472 ' H ' HE21 ' A' ' 571' ' ' GLN . 0.0 OUTLIER -119.91 98.9 6.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.832 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.485 ' HG1' ' H ' ' A' ' 574' ' ' SER . 30.5 p -86.63 -152.54 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.859 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.485 ' HB ' ' HB1' ' A' ' 616' ' ' ALA . 30.4 p -101.56 -10.77 19.81 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.687 0.255 . . . . 0.0 111.687 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.485 ' H ' ' HG1' ' A' ' 572' ' ' THR . 76.2 p -125.71 -33.86 2.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -123.44 159.43 29.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.945 0.403 . . . . 0.0 111.171 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.475 HD11 HG21 ' A' ' 642' ' ' VAL . 11.0 tt -142.07 151.42 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 5.5 m -118.82 127.62 53.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.794 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -121.39 137.87 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.332 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 37.5 t -128.6 146.76 50.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.282 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.498 ' HB3' HD12 ' A' ' 566' ' ' LEU . 48.1 p90 -157.79 170.07 23.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.924 0.392 . . . . 0.0 111.323 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.74 125.51 29.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.233 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.34 153.14 35.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.347 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.641 ' H ' ' HH ' ' A' ' 592' ' ' TYR . 1.7 p -70.72 169.72 13.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.789 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.22 -19.19 20.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.959 0.409 . . . . 0.0 111.114 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -89.03 37.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.767 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -58.46 -13.31 5.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.2 3.45 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.059 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -143.65 -24.73 0.16 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 10.2 t -61.24 144.98 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 111.066 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 16.6 p -124.69 -9.96 7.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.286 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.615 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.03 172.45 36.54 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.513 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.641 ' HH ' ' H ' ' A' ' 583' ' ' SER . 80.7 m-85 -124.65 134.12 53.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 111.16 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.409 ' HB3' HD12 ' A' ' 600' ' ' LEU . 78.8 m-20 -100.94 135.84 41.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.451 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.552 ' HB ' HG21 ' A' ' 602' ' ' THR . 97.8 t -101.75 135.13 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.6 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 57.0 m-85 -112.6 129.5 56.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.647 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -122.06 107.85 12.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 57.88 59.59 10.55 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.291 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.1 p 52.64 33.24 13.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.949 0.404 . . . . 0.0 111.327 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.81 111.6 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -47.81 153.67 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.623 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.419 ' HB1' ' H ' ' A' ' 602' ' ' THR . . . -134.93 -86.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.307 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.629 HG22 HG13 ' A' ' 611' ' ' ILE . 14.6 t -90.5 171.24 9.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.191 0.52 . . . . 0.0 111.85 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 46.5 m -140.36 123.53 16.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.494 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 16.0 m -128.27 -169.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.926 0.393 . . . . 0.0 111.549 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.615 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.1 p -142.0 -31.55 0.54 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.964 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -76.26 -125.22 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.435 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 16.7 p -122.84 -13.09 7.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.734 0.302 . . . . 0.0 111.159 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.425 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 50.0 p -108.67 155.71 20.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.021 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -139.35 145.28 38.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.071 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.4 m -127.01 119.76 27.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.2 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.629 HG13 HG22 ' A' ' 602' ' ' THR . 3.6 mp -104.75 139.51 25.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.936 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.83 163.74 16.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 80.6 39.27 14.78 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.509 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -96.55 162.76 13.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 110.996 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -125.46 127.03 45.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.913 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.485 ' HB1' ' HB ' ' A' ' 573' ' ' THR . . . -59.31 160.12 6.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.447 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.83 43.66 30.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.207 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.7 m -140.42 146.46 38.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.396 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 6.0 t -86.92 137.54 32.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.472 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -140.12 131.14 26.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.015 0.436 . . . . 0.0 112.113 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.486 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -106.31 130.33 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.482 178.647 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -123.17 166.96 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.375 0.607 . . . . 0.0 112.548 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.09 160.48 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.822 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.25 150.95 34.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.098 0.475 . . . . 0.0 111.574 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.514 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.9 mmtt -140.18 149.73 43.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.872 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.461 ' O ' HG22 ' A' ' 633' ' ' VAL . . . -110.63 150.42 29.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.747 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 141.81 39.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.752 0.311 . . . . 0.0 111.208 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -108.04 165.23 11.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.29 9.98 21.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -96.19 -0.04 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.075 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 90.22 27.77 19.68 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.489 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -128.1 159.68 34.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.721 0.296 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 626' ' ' ALA . 2.6 p -139.53 145.97 26.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.349 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.445 ' HB3' ' HG2' ' A' ' 560' ' ' PRO . 51.4 p -82.71 -174.81 5.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.622 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -90.28 178.69 6.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.995 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.514 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -88.0 142.95 27.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 2.4 p -77.2 -166.8 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.216 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.02 140.35 45.37 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.787 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.72 119.52 22.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.814 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.486 ' O ' ' HA ' ' A' ' 621' ' ' THR . 8.7 p -99.88 138.36 24.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.165 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.9 t -107.13 89.15 2.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.699 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.475 HG21 HD11 ' A' ' 576' ' ' ILE . 3.7 m -110.02 141.15 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.595 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -95.97 163.17 13.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.653 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 616' ' ' ALA . 4.9 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.224 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 65.7 m80 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.859 0.361 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 4.0 mtt -123.57 -64.35 1.16 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.815 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -65.53 137.45 96.49 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.06 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.408 ' HB2' ' H ' ' A' ' 561' ' ' THR . 90.4 Cg_endo -76.94 -149.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.593 2.196 . . . . 0.0 112.256 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.422 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -113.97 114.49 26.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.046 179.786 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -60.58 128.89 88.99 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.983 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.24 151.77 4.14 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.492 2.128 . . . . 0.0 111.899 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.55 156.09 45.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 59.09 45.53 14.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.725 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.594 HD23 HG23 ' A' ' 624' ' ' VAL . 48.8 tp -66.71 156.7 34.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.426 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.11 168.87 21.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 59.9 p -124.04 143.93 50.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.156 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 14.9 p -125.05 -86.35 0.63 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.578 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.573 ' HB3' ' HG1' ' A' ' 577' ' ' THR . . . -81.79 98.89 8.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 111.194 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.439 HE21 ' HB2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -118.28 102.4 8.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.86 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 15.1 p -87.87 -152.02 0.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.842 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.3 p -100.83 -22.65 14.78 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.672 0.272 . . . . 0.0 111.627 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.0 p -122.22 -7.63 8.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.318 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.19 165.18 27.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.898 0.38 . . . . 0.0 111.038 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.444 HG23 HD12 ' A' ' 611' ' ' ILE . 18.6 tt -156.32 144.52 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.011 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.573 ' HG1' ' HB3' ' A' ' 570' ' ' ALA . 1.9 m -120.74 127.6 52.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.074 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.431 ' HA ' HD22 ' A' ' 578' ' ' LEU . 45.2 mt -119.75 136.16 54.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.8 t -126.29 139.06 53.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.316 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.539 ' HB3' HD11 ' A' ' 566' ' ' LEU . 41.8 p90 -150.62 169.69 20.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.852 0.358 . . . . 0.0 111.378 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 16.6 m -79.93 131.31 35.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.154 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.23 178.67 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.474 ' H ' ' HH ' ' A' ' 592' ' ' TYR . 0.8 OUTLIER -84.63 169.87 13.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 1.4 p -99.2 -15.54 18.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.722 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.04 61.28 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.017 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -73.83 1.53 10.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.005 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.75 -12.47 12.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.325 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -133.98 -18.92 0.93 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.594 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 5.3 t -72.79 147.51 9.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.851 0.358 . . . . 0.0 111.105 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.5 p -117.91 -49.65 2.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.197 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.553 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -150.1 171.78 30.03 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.783 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.474 ' HH ' ' H ' ' A' ' 583' ' ' SER . 52.6 m-85 -118.61 133.42 55.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.739 0.304 . . . . 0.0 110.786 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.618 ' HB3' HD23 ' A' ' 600' ' ' LEU . 0.5 OUTLIER -111.35 120.5 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.943 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.437 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.37 138.36 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.811 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.509 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 95.7 m-85 -99.97 154.88 18.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.556 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.412 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 13.6 t30 -128.2 84.59 2.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.256 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 97.13 -71.06 0.75 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.426 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.26 4.36 0.14 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 111.378 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -128.2 172.09 11.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.618 HD23 ' HB3' ' A' ' 593' ' ' ASP . 1.0 OUTLIER -79.97 119.8 23.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.8 179.783 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.412 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -90.56 -105.47 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.011 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.558 HG23 HG13 ' A' ' 611' ' ' ILE . 14.4 t -90.5 162.27 15.12 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 111.238 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -127.69 128.83 46.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.427 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.0 m -134.45 -176.35 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.375 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.553 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 73.1 p -140.88 -15.42 0.9 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -91.46 -121.29 2.59 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.621 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.7 p -127.99 -4.41 5.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.831 0.348 . . . . 0.0 111.317 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.9 168.86 9.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.136 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.427 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -154.27 119.4 5.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.915 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.5 m -107.33 120.21 41.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.409 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.558 HG13 HG23 ' A' ' 602' ' ' THR . 3.3 mp -109.42 131.04 61.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.749 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 87.4 p -111.98 172.09 7.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 62.5 80.58 0.11 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.469 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.1 mt -137.87 179.58 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.856 0.36 . . . . 0.0 110.959 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -124.94 155.23 39.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.905 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 161.84 15.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.317 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 6.2 t70 55.68 43.4 28.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.059 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.37 139.05 35.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.333 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.2 t -86.05 131.24 34.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -129.34 137.39 50.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.282 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.13 119.44 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.379 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -113.55 159.87 19.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 111.901 -179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.73 137.69 11.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.217 -0.902 . . . . 0.0 109.792 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.594 HG23 HD23 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.94 149.05 6.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.024 0.44 . . . . 0.0 111.569 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.509 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 2.7 mmtp -136.79 152.94 50.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.04 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.45 137.63 50.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.236 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.44 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -108.78 170.08 8.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.61 11.04 16.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.999 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -105.51 -13.52 15.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 98.88 41.34 3.11 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.547 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -135.93 130.4 33.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.5 t -124.7 131.09 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.09 175.21 9.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.929 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -65.26 168.05 7.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.265 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.498 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -79.53 140.15 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.404 ' CB ' HG21 ' A' ' 624' ' ' VAL . 1.2 t -67.66 -179.49 1.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.013 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -65.57 153.75 40.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.667 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.51 142.35 31.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.299 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.545 HG21 HD22 ' A' ' 566' ' ' LEU . 3.7 m -129.91 114.33 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.74 123.52 34.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.34 119.48 55.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.181 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -92.01 101.34 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.194 -0.907 . . . . 0.0 111.104 -179.872 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.771 0.32 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 81.7 mtp -83.83 -17.05 42.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.921 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -62.55 154.54 72.87 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.436 ' HB2' ' H ' ' A' ' 561' ' ' THR . 49.2 Cg_endo -68.17 -152.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.533 2.155 . . . . 0.0 112.445 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.737 ' HB ' ' HB3' ' A' ' 583' ' ' SER . 5.7 m -111.53 131.31 55.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.012 0.434 . . . . 0.0 111.396 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.479 ' HB2' ' N ' ' A' ' 635' ' ' ALA . . . -59.58 130.68 88.04 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.383 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.54 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -45.69 146.13 3.94 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.74 2.293 . . . . 0.0 111.819 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.3 p -119.95 137.13 54.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.992 0.425 . . . . 0.0 112.005 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 54.79 94.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.035 179.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.806 HD13 ' HG ' ' A' ' 578' ' ' LEU . 54.6 tp -89.8 160.36 16.55 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.547 ' H ' HD11 ' A' ' 566' ' ' LEU . . . -160.75 178.74 9.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.422 . . . . 0.0 111.684 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.37 149.4 36.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.421 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 5.4 p -124.83 -84.82 0.64 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.602 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.48 112.5 20.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.433 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.58 ' HB2' HG13 ' A' ' 576' ' ' ILE . 3.4 tt0 -134.9 114.02 12.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.904 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 23.8 p -104.07 -165.78 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.82 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -91.17 29.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 11.3 p -162.33 -39.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.021 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.19 171.77 8.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.958 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.5 tt -159.48 151.19 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.419 . . . . 0.0 111.164 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.3 m -119.43 133.69 55.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.793 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.806 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -121.79 131.39 54.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.027 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.83 127.96 46.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.525 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . . . . . . . . . 45.6 p90 -137.29 170.05 16.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.5 m -84.79 134.59 34.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.028 0.442 . . . . 0.0 111.344 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.55 168.63 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.009 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.737 ' HB3' ' HB ' ' A' ' 561' ' ' THR . 1.2 m -79.75 162.52 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.795 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.72 -7.15 58.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.793 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -125.16 64.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.06 0.92 16.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.71 -9.54 13.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.105 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -130.86 -21.22 1.12 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.405 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.418 HG12 ' N ' ' A' ' 590' ' ' THR . 22.9 t -70.43 141.81 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.418 ' N ' HG12 ' A' ' 589' ' ' VAL . 7.1 t -126.14 -11.43 6.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.111 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.579 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -178.03 -177.57 46.88 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.715 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.455 ' HH ' ' H ' ' A' ' 583' ' ' SER . 88.6 m-85 -134.02 157.94 44.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.935 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -120.41 129.66 54.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.463 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.593 ' HB ' HG21 ' A' ' 602' ' ' THR . 56.8 t -99.61 140.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.231 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.487 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 92.0 m-85 -123.64 147.93 46.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.419 ' HA ' ' O ' ' A' ' 621' ' ' THR . 25.1 t30 -137.95 88.91 2.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 76.29 59.26 3.39 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.093 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 43.4 p 50.46 44.46 26.94 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.891 0.377 . . . . 0.0 111.261 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.04 121.0 4.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.381 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.44 HD21 ' O ' ' A' ' 594' ' ' VAL . 1.0 OUTLIER -54.97 130.73 42.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.872 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.432 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -112.93 -98.65 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.349 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.593 HG21 ' HB ' ' A' ' 594' ' ' VAL . 14.7 t -90.61 171.6 9.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.117 0.484 . . . . 0.0 111.821 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.484 ' H ' ' HG1' ' A' ' 602' ' ' THR . 2.8 m -137.58 127.8 26.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.46 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.432 HG13 ' O ' ' A' ' 608' ' ' THR . 15.5 m -130.59 -178.22 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.906 0.384 . . . . 0.0 111.542 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.579 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 1.4 p -133.21 -24.93 1.81 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.168 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -85.64 -126.25 1.71 Allowed Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.467 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.44 7.93 6.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.827 0.346 . . . . 0.0 111.039 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -129.2 152.83 48.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.971 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -126.9 155.7 42.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.02 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 89.0 m -134.73 109.11 8.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.997 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.441 HG13 HG22 ' A' ' 602' ' ' THR . 3.3 mp -110.52 116.12 51.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.002 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.71 -174.44 2.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.862 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.27 47.65 77.99 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.635 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.2 mt -117.73 173.84 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.881 0.372 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -135.76 169.87 16.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -84.62 171.11 12.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.364 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 55.7 42.42 29.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.814 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.22 143.19 42.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.285 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 619' ' ' SER . . . . . 0.435 ' HA ' ' HG3' ' A' ' 643' ' ' LYS . 0.1 OUTLIER -98.61 132.21 44.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.218 179.349 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -126.62 125.9 42.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.437 . . . . 0.0 111.911 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 596' ' ' ASN . 1.8 p -110.22 107.71 17.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.643 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 623' ' ' THR . 39.1 m-85 -100.15 156.33 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.523 0.677 . . . . 0.0 112.729 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 622' ' ' PHE . 0.9 OUTLIER -159.22 122.13 3.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.306 179.181 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.486 ' CG2' HD12 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.17 157.45 3.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 0.0 111.739 -179.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 635' ' ' ALA . 0.2 OUTLIER -139.98 155.06 47.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.341 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.451 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -104.51 132.14 51.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.793 0.33 . . . . 0.0 110.945 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 632' ' ' ASN . 4.3 pttm -120.81 159.83 24.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.96 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 630' ' ' ALA . 0.4 OUTLIER -112.97 177.85 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -76.64 -19.8 57.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.648 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . 0.402 ' H ' ' CG ' ' A' ' 628' ' ' ASP . . . -100.62 31.64 3.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.52 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 56.42 81.38 0.07 OUTLIER Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.726 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.449 ' O ' ' HA ' ' A' ' 627' ' ' LYS . 1.9 t-20 -160.38 126.64 4.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 0.0 110.716 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 6.5 m -121.89 143.91 32.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.96 0.41 . . . . 0.0 111.711 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.465 ' O ' ' HE2' ' A' ' 625' ' ' LYS . 0.9 OUTLIER -82.78 -145.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.075 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.479 ' N ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.68 177.19 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 110.998 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.51 138.15 31.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.945 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.54 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 12.8 p -67.57 -169.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.855 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -63.36 177.68 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -106.2 121.31 43.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 t -112.03 115.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.684 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 11.1 t -102.47 102.45 12.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.966 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.64 114.77 48.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.928 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.435 ' HG3' ' HA ' ' A' ' 619' ' ' SER . 0.0 OUTLIER -96.86 122.07 39.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.123 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.159 179.768 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.734 0.302 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.9 ptm -144.09 -81.78 0.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.96 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -63.88 141.22 97.98 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.047 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.74 -179.2 3.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.683 2.255 . . . . 0.0 112.459 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.05 136.66 34.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.24 129.4 94.04 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.5 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.45 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.82 140.08 10.14 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.69 2.26 . . . . 0.0 112.201 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.6 t -122.96 153.64 39.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.907 0.384 . . . . 0.0 111.727 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.94 62.55 1.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.787 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.784 HD13 ' HG ' ' A' ' 578' ' ' LEU . 55.3 tp -82.4 158.93 23.12 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.452 ' H ' HD11 ' A' ' 566' ' ' LEU . . . -161.28 176.03 11.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.996 0.426 . . . . 0.0 111.786 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 20.6 p -130.24 122.62 28.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.233 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.8 p -99.83 -86.8 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.69 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.02 96.76 10.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.252 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.81 102.45 9.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 80.9 p -94.69 -155.43 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.18 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.428 ' HB ' ' HB3' ' A' ' 616' ' ' ALA . 4.9 p -90.16 3.36 53.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.473 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 3.4 p -152.49 -49.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.66 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -99.96 122.28 42.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.794 0.33 . . . . 0.0 111.408 -179.536 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.512 HG21 HD21 ' A' ' 614' ' ' LEU . 14.5 tt -115.49 150.22 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 18.6 m -120.27 119.33 32.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.756 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.784 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -105.85 136.41 45.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.938 -179.617 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.8 122.69 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.49 ' HB3' ' CD1' ' A' ' 566' ' ' LEU . 40.4 p90 -138.45 169.59 17.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.029 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 m -85.27 147.32 26.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.216 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.42 168.19 7.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.339 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.414 ' HB3' ' HH ' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -78.14 -2.15 36.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.885 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 21.45 11.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.168 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.482 ' O ' HG21 ' A' ' 589' ' ' VAL . 25.2 m-20 -153.12 75.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.018 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -87.68 33.86 0.71 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.977 0.418 . . . . 0.0 110.829 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -85.56 -1.25 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.986 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -159.99 -25.84 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 13.6 t -59.03 146.81 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 111.258 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.453 ' N ' HG12 ' A' ' 589' ' ' VAL . 1.7 p -120.05 -40.0 2.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.974 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.588 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -159.53 177.29 36.11 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.394 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.416 ' O ' HG22 ' A' ' 604' ' ' VAL . 94.8 m-85 -123.09 120.12 32.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.812 0.339 . . . . 0.0 111.016 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.458 ' OD1' HG23 ' A' ' 603' ' ' THR . 4.7 m-20 -99.81 120.96 40.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.553 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -100.69 140.36 19.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 0.0 110.861 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.4 ' CE1' ' HG3' ' A' ' 625' ' ' LYS . 85.0 m-85 -99.21 170.71 8.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.004 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -140.26 86.35 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.608 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 83.95 -68.34 3.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.257 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.4 p -151.28 -12.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 140.79 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.922 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.434 HD13 ' HB3' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -55.24 149.11 13.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.423 ' HB3' ' H ' ' A' ' 602' ' ' THR . . . -114.63 -107.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.011 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.423 ' H ' ' HB3' ' A' ' 601' ' ' ALA . 5.0 t -90.73 168.93 11.38 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.155 0.502 . . . . 0.0 111.667 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.458 HG23 ' OD1' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -132.37 121.26 23.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.543 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.451 HG13 ' HA ' ' A' ' 609' ' ' ALA . 31.5 m -125.64 -171.71 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.507 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.588 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.3 p -140.2 -12.41 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.145 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.11 -139.09 10.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.451 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 68.3 p -111.93 11.98 20.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 0.0 111.035 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -132.82 154.25 50.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.967 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.451 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -136.43 136.56 39.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.6 113.18 20.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.869 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.484 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.3 mt -107.26 144.09 16.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.55 -166.13 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 59.19 -108.56 1.67 Allowed Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.064 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.512 HD21 HG21 ' A' ' 576' ' ' ILE . 0.3 OUTLIER 56.89 104.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.958 179.109 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -70.01 111.69 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.634 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.428 ' HB3' ' HB ' ' A' ' 573' ' ' THR . . . -56.35 164.9 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.479 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 59.6 27.64 16.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.06 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.4 m -141.07 138.28 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.7 p -80.75 146.48 30.99 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.632 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -140.41 147.86 40.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.939 0.4 . . . . 0.0 111.56 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.567 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.49 120.29 39.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.06 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -109.2 163.01 13.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.32 0.581 . . . . 0.0 112.213 -178.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 637' ' ' SER . 0.8 OUTLIER -155.09 142.92 19.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.604 179.301 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.502 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -107.94 142.5 20.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.076 0.465 . . . . 0.0 111.633 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.4 ' HG3' ' CE1' ' A' ' 595' ' ' TYR . 7.1 mmtt -132.42 143.34 49.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.898 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.446 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -103.87 138.47 40.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' A' ' 633' ' ' VAL . 0.2 OUTLIER -128.55 137.0 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.502 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 0.0 OUTLIER -101.42 168.03 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.981 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.84 51.84 2.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.107 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -152.53 -25.43 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.21 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 116.58 28.66 2.47 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.302 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -121.9 124.63 44.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 0.0 110.682 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.41 HG11 ' HB3' ' A' ' 627' ' ' LYS . 9.4 m -120.83 135.82 59.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.375 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.446 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 10.2 p -69.85 -167.52 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.26 164.04 14.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -74.86 126.58 31.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.443 ' OG ' HG21 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.92 -177.12 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.624 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.11 157.67 9.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.567 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -90.35 131.17 36.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.414 HG11 ' HG ' ' A' ' 566' ' ' LEU . 3.1 m -114.04 109.71 29.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.049 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.6 119.77 27.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 12.1 m -123.88 160.28 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.222 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.68 112.18 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 62.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.168 -179.967 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.3 m80 . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.785 0.326 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 57.9 21.67 7.88 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -70.9 146.69 93.43 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.914 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.56 -159.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.569 2.18 . . . . 0.0 112.276 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.435 ' O ' ' HB2' ' A' ' 583' ' ' SER . 4.5 p -112.59 123.63 50.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -59.11 132.22 87.37 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.699 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 626' ' ' ALA . 78.5 Cg_exo -49.98 176.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.101 2.534 . . . . 0.0 112.413 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 5.1 t -155.66 148.92 24.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 111.605 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 56.77 68.01 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.653 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.683 HD11 ' HG ' ' A' ' 578' ' ' LEU . 49.4 tp -76.78 159.8 29.82 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.475 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.76 179.95 8.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.945 0.402 . . . . 0.0 111.567 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 82.3 p -142.67 130.21 21.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.463 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.7 p -100.6 -82.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.404 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.479 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -86.12 97.08 10.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.25 97.19 7.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.6 p -84.14 -150.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.956 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 36.4 p -96.12 -45.24 6.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.73 0.3 . . . . 0.0 111.575 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 91.6 p -107.71 -3.68 18.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.625 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.467 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -139.69 163.7 31.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 111.135 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . . . . . . . . . 19.5 tt -155.06 149.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.314 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.479 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.2 m -110.7 125.45 53.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.803 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.683 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.6 OUTLIER -108.94 149.26 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.245 -179.566 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.5 t -144.64 135.05 24.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.256 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.484 ' CD2' HG12 ' A' ' 624' ' ' VAL . 42.0 p90 -152.67 169.87 21.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.969 0.414 . . . . 0.0 111.36 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.6 110.61 16.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.781 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . 0.442 ' HB2' ' HH ' ' A' ' 592' ' ' TYR . . . -51.18 151.32 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.304 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.452 ' H ' ' HH ' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -54.44 136.26 44.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.904 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 4.1 m -62.6 -23.63 67.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.858 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.04 46.46 1.01 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.485 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -65.04 -9.62 23.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.1 m -75.04 3.02 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.897 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -142.42 -2.9 1.06 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.427 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 44.7 t -96.22 146.84 6.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.797 0.332 . . . . 0.0 110.967 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.428 HG22 ' N ' ' A' ' 591' ' ' GLY . 8.1 t -111.2 -31.53 7.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.632 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -164.44 -179.9 38.84 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.878 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.452 ' HH ' ' H ' ' A' ' 583' ' ' SER . 82.1 m-85 -133.41 135.52 44.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -113.69 121.23 43.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.356 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.55 140.78 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.947 0.404 . . . . 0.0 111.206 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -98.97 166.16 11.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.978 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -140.24 86.94 2.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 71.49 60.79 4.18 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.009 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.7 p 55.37 37.45 28.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.92 0.39 . . . . 0.0 111.487 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.65 112.25 2.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 600' ' ' LEU . 1.1 tm? -45.88 131.17 9.58 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.353 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.486 ' HB1' ' H ' ' A' ' 602' ' ' THR . . . -113.08 -96.89 0.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.353 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.486 ' H ' ' HB1' ' A' ' 601' ' ' ALA . 6.2 t -90.6 168.29 11.91 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.186 0.517 . . . . 0.0 111.985 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 18.2 m -132.5 141.6 48.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.575 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.411 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 3.5 m -140.35 -177.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.431 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.436 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 36.4 p -140.25 -13.27 1.04 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.932 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -98.1 -124.88 5.09 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.61 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.13 -14.67 8.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.3 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -101.24 176.64 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.46 ' HB2' ' HZ3' ' A' ' 580' ' ' TRP . . . -158.78 123.57 4.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.138 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.6 m -105.42 117.27 33.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.235 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.7 mt -106.8 125.34 62.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.75 173.35 6.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . 0.453 ' O ' HD12 ' A' ' 614' ' ' LEU . . . 65.02 67.62 1.96 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.551 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.453 HD12 ' O ' ' A' ' 613' ' ' GLY . 1.2 mp -130.59 153.5 48.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.966 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -121.45 141.45 50.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.158 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.93 174.31 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.68 28.72 14.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.2 m -139.16 141.42 38.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.99 137.38 32.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.587 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -132.62 133.19 43.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.391 . . . . 0.0 111.409 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -113.92 111.44 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.285 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -102.11 165.36 11.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.215 0.531 . . . . 0.0 111.913 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.47 HG21 ' HA ' ' A' ' 639' ' ' ALA . 0.6 OUTLIER -160.22 150.26 18.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.75 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.518 HG22 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -110.49 145.71 16.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.174 0.511 . . . . 0.0 111.777 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.488 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 1.1 mmtp -134.37 127.58 31.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.775 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.478 ' HB3' ' HD3' ' A' ' 563' ' ' PRO . . . -81.71 142.91 32.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.166 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.59 145.15 38.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -107.13 -177.51 3.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -86.23 -9.2 56.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -87.66 -6.0 58.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.129 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 91.09 23.34 30.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -108.27 148.09 30.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.686 0.279 . . . . 0.0 110.698 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 16.7 m -137.66 146.34 27.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.907 0.384 . . . . 0.0 111.43 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.85 -166.05 1.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.556 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.43 169.88 16.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.806 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.488 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.09 135.62 36.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.72 -175.27 0.66 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.426 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 142.62 57.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.695 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.47 ' HA ' HG21 ' A' ' 623' ' ' THR . . . -81.72 123.11 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 621' ' ' THR . 9.6 p -99.66 144.46 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.734 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.9 t -118.89 109.74 16.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.87 134.2 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.34 115.93 28.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.723 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.9 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.005 179.975 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.739 0.304 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 3.6 mtm 59.41 20.53 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.5 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -79.51 152.72 75.82 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.99 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.45 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.428 2.085 . . . . 0.0 112.25 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.534 HG22 ' H ' ' A' ' 584' ' ' THR . 0.1 OUTLIER -103.77 130.41 51.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.968 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.27 126.9 92.51 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.438 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.6 Cg_exo -47.5 148.15 5.69 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.556 2.171 . . . . 0.0 112.094 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 30.6 p -138.58 161.11 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 111.387 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.1 51.85 8.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.609 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.596 HD12 ' HB3' ' A' ' 580' ' ' TRP . 11.5 tp -73.89 158.61 34.15 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.567 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -177.64 6.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 111.531 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 86.8 p -138.97 125.72 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.368 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.1 p -99.8 -86.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.509 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.19 102.78 15.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.195 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.494 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.7 OUTLIER -121.25 116.86 25.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.957 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.5 p -98.56 -159.15 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.195 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.534 HG23 ' HB3' ' A' ' 616' ' ' ALA . 0.9 OUTLIER -89.75 2.43 54.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.536 -179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 98.3 p -142.39 -47.99 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.803 0.335 . . . . 0.0 111.195 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 1.0 OUTLIER -100.08 166.37 11.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.82 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.494 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.3 tt -154.91 142.58 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 7.0 m -109.21 113.55 26.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.78 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 608' ' ' THR . 1.0 OUTLIER -102.86 134.06 46.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.203 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 t -128.64 133.97 48.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.596 ' HB3' HD12 ' A' ' 566' ' ' LEU . 42.9 p90 -146.94 169.76 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.171 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -79.98 132.4 36.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.262 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.15 159.8 28.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.094 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.2 p -74.78 158.73 32.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.79 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' THR . . . . . 0.534 ' H ' HG22 ' A' ' 561' ' ' THR . 0.1 OUTLIER -69.86 -17.87 63.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.265 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -103.42 161.73 13.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -160.96 -10.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -6.34 8.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.746 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.33 -35.44 0.37 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.506 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.416 HG11 ' N ' ' A' ' 590' ' ' THR . 4.7 t -59.07 148.45 6.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.416 ' N ' HG11 ' A' ' 589' ' ' VAL . 0.2 OUTLIER -133.5 -19.27 2.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.369 -179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.543 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.73 173.42 46.05 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.806 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -127.84 130.4 48.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.683 0.278 . . . . 0.0 110.836 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.84 126.26 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.614 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.43 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -100.48 137.19 28.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.01 0.433 . . . . 0.0 111.625 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.732 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 98.0 m-85 -102.36 157.61 16.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.87 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -140.4 100.19 3.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.625 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 58.18 68.56 1.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.202 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.2 p 48.12 33.26 3.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.424 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.47 105.7 1.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.768 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.732 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.5 OUTLIER -47.92 137.7 9.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.386 -179.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.452 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -107.28 -98.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.9 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.452 ' H ' ' HB2' ' A' ' 601' ' ' ALA . 4.0 t -90.64 168.39 11.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.185 0.517 . . . . 0.0 111.741 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 5.1 m -133.19 134.58 44.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.302 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 10.9 m -134.54 -179.75 3.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.496 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.543 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 40.5 p -132.29 -5.94 3.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.31 -131.04 6.9 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.471 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.09 4.69 10.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 111.063 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -128.63 140.1 51.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.9 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.444 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -119.79 157.77 27.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.164 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.75 102.46 5.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.962 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.419 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.2 mt -99.64 121.03 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.98 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.8 t -110.91 174.75 5.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.45 62.28 4.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.466 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 7.9 mt -130.74 143.14 50.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.866 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.24 142.92 35.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.043 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.534 ' HB3' HG23 ' A' ' 573' ' ' THR . . . -76.99 159.22 30.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.285 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 11.5 t0 55.48 49.68 16.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.065 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.3 m -139.96 144.55 37.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 619' ' ' SER . . . . . 0.499 ' HA ' ' HG2' ' A' ' 643' ' ' LYS . 13.6 t -85.12 112.77 20.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.518 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.3 m-85 -115.83 134.54 54.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.954 0.406 . . . . 0.0 111.607 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.3 OUTLIER -111.31 125.34 53.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.235 179.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.417 ' H ' HG13 ' A' ' 640' ' ' VAL . 73.2 m-85 -118.96 162.09 19.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.27 0.557 . . . . 0.0 111.935 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.493 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.03 138.56 10.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.861 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.43 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -100.78 151.6 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.065 0.46 . . . . 0.0 111.691 -179.576 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.437 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.6 mmtp -136.77 143.19 43.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.945 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -101.7 143.24 31.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.428 ' HZ2' ' HG2' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -139.0 149.71 45.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.708 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.27 174.89 5.65 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.15 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.37 45.48 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.373 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -151.34 -17.47 0.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.957 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 105.44 36.5 2.84 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.343 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.5 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 87.5 m-20 -119.15 109.56 16.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.762 0.315 . . . . 0.0 110.827 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 25.5 m -109.08 131.25 60.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.296 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -168.63 0.72 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.659 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -72.91 173.22 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.834 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.422 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -88.46 136.46 32.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.856 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.426 ' CB ' HG22 ' A' ' 624' ' ' VAL . 4.8 t -63.98 -174.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.273 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 143.71 48.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.686 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.493 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.68 127.59 32.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.281 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.448 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.4 p -104.39 116.25 47.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.93 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.45 81.39 6.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.557 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 642' ' ' VAL . 11.0 p -103.78 139.69 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.172 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.499 ' HG2' ' HA ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -111.54 155.53 23.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.654 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.246 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.757 0.313 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 21.3 mmt 60.76 -86.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -68.66 156.63 90.47 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.452 ' HB2' ' H ' ' A' ' 561' ' ' THR . 59.2 Cg_endo -70.91 -144.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.663 2.242 . . . . 0.0 112.168 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.692 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -117.0 121.23 40.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 635' ' ' ALA . . . -63.42 130.12 94.06 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.142 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.463 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.2 Cg_exo -48.95 170.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.808 2.339 . . . . 0.0 112.341 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 4.6 t -158.49 159.13 35.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.252 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 55.88 59.68 3.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.492 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.855 HD13 ' HG ' ' A' ' 578' ' ' LEU . 2.1 tp -85.58 155.51 21.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.642 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.74 175.52 12.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.322 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 18.8 p -123.72 134.23 53.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.6 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.99 -86.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.275 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.711 ' HB2' ' HG1' ' A' ' 577' ' ' THR . . . -90.66 98.58 11.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.422 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.512 ' NE2' ' HB ' ' A' ' 642' ' ' VAL . 11.1 tt0 -111.36 134.5 52.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 24.1 p -126.18 -162.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 35.5 p -94.0 24.25 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.244 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.411 ' O ' HD13 ' A' ' 614' ' ' LEU . 53.2 p -165.79 -47.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.1 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -114.57 126.82 55.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.186 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.507 HG13 ' HB2' ' A' ' 571' ' ' GLN . 18.1 tt -120.44 144.78 28.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.061 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.711 ' HG1' ' HB2' ' A' ' 570' ' ' ALA . 28.3 m -104.63 133.03 50.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.855 ' HG ' HD13 ' A' ' 566' ' ' LEU . 1.2 tp -121.78 143.86 49.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.02 0.438 . . . . 0.0 111.386 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -139.4 138.59 36.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.396 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.621 ' HB3' HD11 ' A' ' 566' ' ' LEU . 44.4 p90 -153.55 169.67 22.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 111.269 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.49 128.37 33.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.184 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.54 169.64 2.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.692 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 11.3 p -67.9 -13.89 62.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.17 11.86 4.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.279 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -109.9 -65.05 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.634 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 41.1 t30 55.85 21.22 4.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.235 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.31 -25.25 36.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -162.78 2.11 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.405 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.408 HG12 ' N ' ' A' ' 590' ' ' THR . 10.2 t -64.93 146.27 13.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.32 . . . . 0.0 111.016 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.408 ' N ' HG12 ' A' ' 589' ' ' VAL . 20.7 p -115.7 -38.96 3.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.46 176.82 40.97 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.717 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.683 ' HH ' ' H ' ' A' ' 583' ' ' SER . 85.8 m-85 -117.85 149.29 41.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.724 0.297 . . . . 0.0 110.724 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.56 116.28 20.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.876 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.583 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.98 137.52 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -99.44 168.75 9.79 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.087 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -135.15 88.07 2.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.541 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 93.84 -64.13 1.8 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.238 -179.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -152.96 -39.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -90.27 171.15 9.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -75.06 133.12 41.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.437 ' HB3' ' H ' ' A' ' 602' ' ' THR . . . -99.8 -107.44 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.569 HG22 HG13 ' A' ' 611' ' ' ILE . 9.4 t -90.91 168.02 12.0 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.156 0.503 . . . . 0.0 111.554 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 16.6 m -131.49 133.5 45.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.542 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.503 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.2 m -137.87 -174.07 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.561 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.463 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.5 p -138.88 -15.87 1.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.045 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.68 -146.96 20.85 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.743 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.7 p -104.65 20.27 18.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 111.194 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 38.6 p -136.49 160.88 37.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.964 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.503 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.32 148.3 42.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.0 106.25 7.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.569 HG13 HG22 ' A' ' 602' ' ' THR . 2.7 mp -99.91 122.86 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.807 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 83.1 p -100.32 172.6 7.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.928 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 75.73 -87.71 0.85 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.373 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 574' ' ' SER . 1.5 mt 47.62 -156.92 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.836 0.351 . . . . 0.0 111.505 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . 0.405 ' H ' ' HB3' ' A' ' 614' ' ' LEU . . . -164.58 134.74 3.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.791 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -81.96 166.11 20.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.496 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.69 35.92 24.67 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.172 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.33 168.53 19.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.215 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.84 120.72 40.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.192 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -122.9 151.0 42.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.098 0.475 . . . . 0.0 111.993 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.481 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -124.87 130.2 51.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.756 178.837 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.442 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 84.2 m-85 -114.63 155.75 25.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.419 0.628 . . . . 0.0 112.385 -178.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.7 p -149.14 148.55 29.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.502 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.583 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -116.54 153.87 18.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.983 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.436 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 0.5 OUTLIER -140.0 171.64 13.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.664 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.9 125.97 38.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.316 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -116.23 152.09 34.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.998 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -109.68 176.43 5.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.926 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.22 45.95 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.208 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.38 -28.44 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.045 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 123.1 6.71 7.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.343 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -96.94 119.9 36.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.6 p -115.9 147.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.91 -159.72 0.4 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.599 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.14 177.07 6.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.901 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.436 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -87.84 150.54 23.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.979 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -171.87 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -64.93 159.77 22.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -100.81 123.76 45.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.22 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.7 p -99.89 123.34 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.03 103.51 15.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.671 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.512 ' HB ' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -107.52 146.32 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.222 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -104.19 108.15 19.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.732 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.138 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.77 0.319 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' MET . . . . . 0.403 ' HB3' ' HE1' ' A' ' 558' ' ' MET . 2.7 ptp -104.71 -70.89 0.76 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.937 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -63.35 143.41 97.78 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.156 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -72.99 -153.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.616 2.211 . . . . 0.0 112.314 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.606 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 2.4 m -116.11 136.17 53.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -74.9 128.67 84.77 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.151 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -47.45 154.4 1.64 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.681 2.254 . . . . 0.0 112.211 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.84 153.83 47.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.295 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 57.03 66.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.359 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.724 HD11 ' HG ' ' A' ' 578' ' ' LEU . 36.3 tp -86.93 159.8 18.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.276 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.462 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.44 172.93 15.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 0.0 111.732 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' SER . . . . . 0.485 ' HG ' HG13 ' A' ' 642' ' ' VAL . 0.3 OUTLIER -127.39 135.03 49.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.176 179.43 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.68 -85.86 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.775 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.08 102.88 13.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.863 0.364 . . . . 0.0 111.482 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.88 130.61 55.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 63.6 p -124.32 -156.81 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.297 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.2 p -94.69 22.58 6.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.408 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 86.2 p -164.71 -48.76 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.123 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.68 164.53 11.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.935 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.406 HG22 HD13 ' A' ' 611' ' ' ILE . 12.3 tt -158.29 145.6 8.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.329 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 10.0 m -107.32 136.11 47.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.497 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.724 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -127.63 125.5 40.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.872 0.367 . . . . 0.0 111.313 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 29.2 t -121.67 137.92 54.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.354 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.469 ' HB3' HD13 ' A' ' 566' ' ' LEU . 46.4 p90 -150.5 169.7 20.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.36 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 29.9 m -82.24 139.54 34.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.039 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.52 167.93 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.935 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.606 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 90.6 p -69.83 -3.98 18.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 9.9 p 52.52 24.36 3.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.007 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -124.0 -54.45 1.72 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 45.62 -154.74 0.04 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.825 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.4 t 54.32 19.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.151 0.501 . . . . 0.0 110.595 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -170.74 -28.79 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.801 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.409 HG13 ' H ' ' A' ' 591' ' ' GLY . 15.5 t -80.01 134.8 26.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.529 0.205 . . . . 0.0 110.629 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 31.4 p -124.96 23.96 7.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.74 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 152.16 167.86 15.71 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.247 -0.977 . . . . 0.0 113.182 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.27 127.27 37.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.85 0.357 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.488 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 2.7 m-20 -105.39 116.96 32.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.338 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.712 ' HB ' HG11 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.31 137.37 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.933 0.397 . . . . 0.0 111.268 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.442 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 87.1 m-85 -99.68 169.4 9.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.269 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -133.96 84.53 2.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 91.15 -52.66 3.19 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.224 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -158.53 -50.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.736 0.303 . . . . 0.0 111.225 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.85 173.48 12.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.958 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.404 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.8 OUTLIER -79.33 149.29 31.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.404 ' N ' ' HG ' ' A' ' 600' ' ' LEU . . . -116.34 -104.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.748 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.769 HG23 HG13 ' A' ' 611' ' ' ILE . 9.9 t -90.92 162.65 14.67 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 111.151 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 22.8 m -127.33 117.13 21.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.899 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.46 HG13 ' O ' ' A' ' 608' ' ' THR . 19.8 m -124.22 -173.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.507 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.74 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 25.1 p -140.75 -11.86 1.0 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.056 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.58 -140.84 11.56 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.632 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.93 27.99 9.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.786 0.326 . . . . 0.0 111.317 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 604' ' ' VAL . 0.3 OUTLIER -149.93 153.24 36.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.949 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.445 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -137.49 144.09 42.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.028 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 34.5 m -122.35 110.89 16.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.281 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.769 HG13 HG23 ' A' ' 602' ' ' THR . 2.6 mp -105.24 122.02 58.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.957 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 612' ' ' SER . . . . . 0.43 ' HG ' ' H ' ' A' ' 613' ' ' GLY . 7.7 t -117.68 170.39 8.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . 0.43 ' H ' ' HG ' ' A' ' 612' ' ' SER . . . 76.83 52.62 5.74 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.383 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.6 mt -122.27 161.8 22.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.87 0.367 . . . . 0.0 110.926 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.81 158.77 16.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -85.57 164.72 17.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.254 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 37.9 t0 55.91 42.33 28.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.222 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.5 m -140.54 139.24 35.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.407 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.68 136.43 35.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.237 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -135.73 118.66 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 111.739 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.97 107.4 18.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.906 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -99.52 160.48 14.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.363 0.602 . . . . 0.0 112.035 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.5 p -150.89 152.88 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.835 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.712 HG11 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -113.83 152.87 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 111.482 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.0 mmtt -140.17 148.95 42.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.192 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -107.64 139.18 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.111 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.2 149.68 52.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.989 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -113.73 169.89 8.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.866 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.75 7.81 11.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.151 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -104.15 -11.35 17.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.999 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 100.97 15.04 29.65 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.445 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -97.18 141.21 30.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.429 HG11 ' HZ1' ' A' ' 625' ' ' LYS . 14.3 t -133.78 129.33 54.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.02 -171.59 2.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.41 176.0 10.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.18 134.5 34.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 5.0 t -66.0 -179.46 0.74 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.149 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.481 ' ND2' ' H ' ' A' ' 566' ' ' LEU . 1.9 p30 -59.47 163.2 4.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.704 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -96.37 129.04 43.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.42 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.97 105.64 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 73.5 m -84.56 96.17 9.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.485 HG13 ' HG ' ' A' ' 568' ' ' SER . 1.7 m -113.8 126.56 71.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.984 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -86.63 144.4 27.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.098 179.793 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 13.2 m80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.83 0.348 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -109.96 76.84 1.01 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.785 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.502 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -77.78 153.8 80.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -72.72 -165.55 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.506 2.137 . . . . 0.0 112.336 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.757 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 22.8 m -94.2 136.87 34.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.618 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -74.14 129.63 84.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.117 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.52 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -46.45 146.98 4.51 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.486 2.124 . . . . 0.0 112.053 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.1 154.21 51.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.968 0.413 . . . . 0.0 111.646 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.72 70.38 0.64 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.466 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.64 HD22 ' HB ' ' A' ' 640' ' ' VAL . 23.9 tp -83.63 159.59 21.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.391 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.518 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.95 169.77 21.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.834 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 134.2 52.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.417 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.6 p -109.8 -89.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.533 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.52 99.95 12.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.83 0.347 . . . . 0.0 111.367 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.533 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -122.6 120.85 34.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.8 p -110.18 -160.25 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.989 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 68.1 p -93.07 27.96 2.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.055 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.6 p -165.71 -58.6 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.73 129.57 49.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.93 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.533 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.0 tt -120.76 142.89 34.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.387 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 3.1 m -117.21 126.68 53.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 608' ' ' THR . 87.5 mt -119.85 146.44 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.525 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 144.72 51.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.995 179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.597 ' HB3' HD11 ' A' ' 566' ' ' LEU . 47.8 p90 -154.61 170.18 22.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 111.282 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.52 131.22 34.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.815 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . 0.644 ' HB3' ' HH ' ' A' ' 592' ' ' TYR . . . -64.06 176.66 0.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.405 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.757 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 23.7 p -74.55 147.18 41.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.968 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -10.73 59.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.178 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -91.42 -63.13 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 55.81 29.75 14.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.039 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.55 -24.88 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -163.4 6.53 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.657 HG23 ' HG ' ' A' ' 583' ' ' SER . 13.9 t -63.9 121.56 13.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 111.112 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.3 t -119.48 -29.77 5.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.652 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -139.78 174.77 22.18 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.748 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.644 ' HH ' ' HB3' ' A' ' 582' ' ' ALA . 87.6 m-85 -134.58 162.71 31.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.72 0.295 . . . . 0.0 110.691 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.474 ' HB3' HD12 ' A' ' 600' ' ' LEU . 7.6 m-20 -132.09 119.11 20.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.647 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.69 146.27 9.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.866 0.365 . . . . 0.0 110.988 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 34.5 m-85 -120.17 164.66 15.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.822 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -140.32 87.6 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.627 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 67.63 71.35 0.95 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.153 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.7 p 47.49 39.6 9.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.928 0.394 . . . . 0.0 111.221 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -160.33 102.05 1.39 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.057 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.531 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -49.21 136.3 15.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.154 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.437 ' HB3' ' H ' ' A' ' 602' ' ' THR . . . -111.91 -98.4 0.42 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.306 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.461 ' O ' HG11 ' A' ' 594' ' ' VAL . 6.5 t -90.6 170.68 9.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.305 0.574 . . . . 0.0 111.983 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.8 m -136.54 137.26 40.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.864 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.413 HG22 ' O ' ' A' ' 608' ' ' THR . 2.3 m -132.03 -176.1 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.929 0.395 . . . . 0.0 111.955 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.652 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.7 p -130.61 -6.92 4.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.734 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.78 -147.38 9.71 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.536 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.2 p -100.18 1.99 42.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.694 0.283 . . . . 0.0 111.456 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 11.6 p -114.32 165.58 12.56 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.43 ' HB3' HG12 ' A' ' 594' ' ' VAL . . . -151.03 134.13 15.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.2 m -121.84 122.77 40.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.307 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.8 mp -112.76 128.65 69.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.779 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.0 155.46 20.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.0 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 78.45 58.05 3.21 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.509 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.0 mt -115.01 154.5 28.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -103.43 144.77 30.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.021 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -87.39 164.2 16.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.65 35.27 22.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.87 156.93 47.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.336 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.3 t -95.05 137.53 33.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -139.41 134.73 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 111.269 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 37.4 p -114.21 125.65 54.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.078 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -113.46 155.14 25.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.279 0.562 . . . . 0.0 111.957 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.51 122.58 5.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.827 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.647 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.1 OUTLIER -99.25 157.55 3.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.139 0.495 . . . . 0.0 112.029 -178.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 5.7 mttt -136.85 163.54 30.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.411 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -111.08 133.55 53.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 0.0 111.089 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -126.36 143.84 51.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.958 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.52 156.26 19.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.822 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.51 62.69 6.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -157.89 -39.11 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 134.06 44.15 0.12 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.771 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.502 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 63.3 m-80 -141.91 147.95 37.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.728 0.299 . . . . 0.0 110.927 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 633' ' ' VAL . 0.4 OUTLIER -137.36 144.99 30.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.209 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 8.2 p -87.4 -164.69 1.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.752 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.618 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -88.88 177.49 6.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.548 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.531 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.75 141.55 31.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 111.228 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.52 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -72.29 -177.39 2.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.922 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.39 144.18 47.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.689 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.94 112.29 17.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.323 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.64 ' HB ' HD22 ' A' ' 566' ' ' LEU . 1.2 t -100.02 137.13 28.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.591 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.8 m -116.53 109.92 17.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.984 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.8 p -115.37 149.72 17.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.996 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -114.86 128.99 56.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.036 179.816 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.764 0.316 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' MET . . . . . 0.474 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 2.9 mtt -147.31 -98.0 0.09 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.117 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -68.67 141.41 92.79 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.684 0.278 . . . . 0.0 111.159 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.402 ' HB3' HG23 ' A' ' 589' ' ' VAL . 85.2 Cg_endo -81.28 -157.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.629 2.219 . . . . 0.0 112.418 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.86 150.29 28.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.79 128.06 64.92 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -48.1 153.05 3.0 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.703 2.269 . . . . 0.0 112.146 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.07 160.19 41.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.464 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 59.64 45.36 13.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.248 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.601 HD13 ' HB3' ' A' ' 580' ' ' TRP . 63.9 tp -68.07 158.12 33.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.76 0.314 . . . . 0.0 110.68 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -162.07 -176.74 5.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.321 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' SER . . . . . 0.5 ' HA ' HD23 ' A' ' 578' ' ' LEU . 83.8 p -123.37 156.64 35.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.32 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.49 -89.4 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.727 0.299 . . . . 0.0 111.478 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.04 101.46 13.8 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.19 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.82 99.75 7.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.966 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 19.6 p -95.2 -155.18 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.812 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 14.4 p -96.99 19.59 12.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.51 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.434 ' HG ' ' H ' ' A' ' 575' ' ' SER . 92.8 p -165.93 -46.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.136 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.434 ' H ' ' HG ' ' A' ' 574' ' ' SER . 0.1 OUTLIER -101.78 137.88 39.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.422 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -133.1 141.25 45.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.43 131.84 55.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.011 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.545 ' O ' ' HA ' ' A' ' 608' ' ' THR . 76.2 mt -121.89 134.96 54.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.906 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 5.5 t -118.76 140.61 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.679 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.601 ' HB3' HD13 ' A' ' 566' ' ' LEU . 46.6 p90 -152.67 169.72 22.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.085 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.4 m -84.68 115.23 22.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -50.92 153.35 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.199 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.93 142.42 15.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.764 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 23.2 p -59.84 -15.35 20.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.228 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -112.46 153.91 26.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.034 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.521 ' C ' ' H ' ' A' ' 588' ' ' GLY . 0.3 OUTLIER -153.06 -157.83 0.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.548 179.924 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.464 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 28.2 t 71.29 -22.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.365 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . 0.521 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -124.8 -20.84 2.25 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.088 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.402 HG23 ' HB3' ' A' ' 560' ' ' PRO . 96.4 t -70.13 141.8 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 110.693 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.728 HG22 ' HE3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -102.42 -67.07 0.89 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.8 -179.336 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.589 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -145.38 -176.36 19.27 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.005 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -121.79 127.35 50.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.887 0.375 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.437 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 5.5 m-20 -101.65 118.3 36.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.423 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.73 135.18 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.957 0.408 . . . . 0.0 110.909 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.708 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.0 m-85 -102.59 151.1 22.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.847 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -127.74 93.14 3.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.178 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 50.7 72.93 0.42 Allowed Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.926 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.5 p 50.07 37.41 14.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.075 0.464 . . . . 0.0 110.931 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.9 94.66 1.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.728 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.708 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.3 tt -44.92 129.96 7.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.441 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.428 ' HB1' ' H ' ' A' ' 602' ' ' THR . . . -97.58 -103.05 0.19 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.129 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.428 ' H ' ' HB1' ' A' ' 601' ' ' ALA . 12.5 t -90.65 172.51 8.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.139 0.495 . . . . 0.0 111.683 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 63.1 m -138.32 105.29 5.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.268 179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.421 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 25.8 m -105.98 -167.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.576 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.589 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.0 p -142.88 -0.55 1.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.031 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.88 -143.02 7.75 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.655 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 607' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 4.8 p -104.39 6.92 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.086 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -126.22 141.38 51.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.303 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -127.15 117.81 23.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.961 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.19 118.94 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.235 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.422 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -111.86 129.78 66.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.081 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 6.6 p -117.33 142.49 47.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 97.55 64.2 0.89 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.51 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.5 mt -130.86 158.47 40.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.846 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -110.64 138.73 46.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.154 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.83 172.37 8.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.177 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 28.4 t0 56.32 34.91 24.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.262 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.21 141.7 35.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.484 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.92 130.09 35.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.617 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -130.78 142.1 50.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.92 0.391 . . . . 0.0 111.501 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 1.3 m -120.4 133.35 55.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.342 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.458 ' O ' HG21 ' A' ' 640' ' ' VAL . 93.5 m-85 -121.88 156.79 32.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 0.0 112.068 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 3.1 p -152.53 131.6 12.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.587 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.422 HG22 HD11 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -98.84 153.43 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.303 0.573 . . . . 0.0 111.804 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.658 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mttt -140.5 143.39 35.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.492 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -103.76 116.52 32.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 0.0 111.741 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.728 ' HE3' HG22 ' A' ' 590' ' ' THR . 0.0 OUTLIER -108.52 149.53 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.537 179.524 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -103.44 160.25 14.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.754 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.41 50.39 1.45 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.424 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . 0.452 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . . . -155.87 -35.19 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.012 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 132.21 39.74 0.22 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.396 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.482 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 1.5 t-20 -136.16 116.57 13.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.7 p -116.44 146.08 21.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.007 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.25 -167.0 1.7 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -77.14 -179.29 5.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.097 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.44 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.19 144.78 25.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.999 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 2.5 p -75.58 -174.89 2.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.917 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -64.9 150.1 48.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.785 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -83.92 128.19 34.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.204 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.458 HG21 ' O ' ' A' ' 622' ' ' PHE . 2.7 m -111.78 105.39 18.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.991 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.2 91.44 8.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.973 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -99.61 171.61 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -143.5 128.8 18.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.839 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.139 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.884 0.373 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 66.3 mtt -81.25 4.47 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.452 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -59.0 152.48 50.18 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 561' ' ' THR . 73.8 Cg_endo -73.57 -152.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.485 2.123 . . . . 0.0 112.194 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.598 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 17.8 m -113.67 127.75 56.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.119 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.42 131.72 92.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.109 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.429 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.51 159.61 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.883 2.389 . . . . 0.0 112.141 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.4 p -134.49 138.03 44.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.997 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.73 84.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.202 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.599 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 10.6 tp -90.63 159.39 16.44 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.599 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.73 164.46 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.037 0.446 . . . . 0.0 111.805 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' SER . . . . . 0.409 ' HA ' HD11 ' A' ' 578' ' ' LEU . 47.3 p -111.55 138.44 48.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.256 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' THR . . . . . 0.566 ' HG1' HG22 ' A' ' 577' ' ' THR . 0.1 OUTLIER -116.66 -89.88 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.621 ' HB1' ' HG1' ' A' ' 577' ' ' THR . . . -89.71 102.76 15.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 111.461 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.474 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.69 143.49 46.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.69 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.459 ' HB ' ' H ' ' A' ' 573' ' ' THR . 24.6 p -129.92 -159.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.957 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.459 ' H ' ' HB ' ' A' ' 572' ' ' THR . 42.9 p -89.65 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.658 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.8 p -142.04 -50.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.791 0.329 . . . . 0.0 111.212 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -101.58 167.25 10.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.85 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.474 HG13 ' HB2' ' A' ' 571' ' ' GLN . 15.1 tt -155.92 147.42 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.621 ' HG1' ' HB1' ' A' ' 570' ' ' ALA . 20.8 m -110.02 142.34 41.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.805 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.565 ' HG ' HD12 ' A' ' 566' ' ' LEU . 0.8 OUTLIER -132.89 133.4 43.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -127.55 139.95 52.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.592 ' HB3' HD13 ' A' ' 566' ' ' LEU . 45.0 p90 -154.39 169.68 23.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.3 m -81.5 138.15 35.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.335 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . 0.414 ' HB2' ' HH ' ' A' ' 592' ' ' TYR . . . -69.39 171.84 8.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.223 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.598 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.9 OUTLIER -73.35 179.12 4.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.774 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -11.07 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.323 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -77.79 -63.98 1.26 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.051 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.8 m120 56.67 -161.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.774 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t 52.95 25.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.128 0.489 . . . . 0.0 110.655 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.97 -30.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.991 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 33.5 t -66.83 138.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.709 0.29 . . . . 0.0 110.508 179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.55 -65.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.629 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.497 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -136.42 -164.79 10.33 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.31 -0.947 . . . . 0.0 113.251 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.415 ' HB2' ' HZ2' ' A' ' 580' ' ' TRP . 95.3 m-85 -135.25 138.86 43.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.738 0.304 . . . . 0.0 111.009 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.14 119.22 38.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.414 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.517 HG13 HG22 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.2 137.78 25.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.445 ' HB2' ' HG1' ' A' ' 623' ' ' THR . 30.5 m-85 -104.13 147.76 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.726 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -109.05 84.15 1.87 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.323 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.5 -77.78 1.98 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -142.56 12.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.995 0.426 . . . . 0.0 111.138 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -132.69 174.51 10.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.382 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.95 133.91 34.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.77 0.319 . . . . 0.0 110.516 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.21 -108.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.692 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.582 ' HG1' ' H ' ' A' ' 603' ' ' THR . 3.4 t -91.79 171.83 8.88 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.303 0.573 . . . . 0.0 111.813 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.582 ' H ' ' HG1' ' A' ' 602' ' ' THR . 0.2 OUTLIER -133.6 124.66 27.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.913 179.467 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.588 HG12 ' HA ' ' A' ' 609' ' ' ALA . 10.6 m -121.67 175.02 5.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.928 0.394 . . . . 0.0 112.027 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.497 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -132.56 -14.87 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.942 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -95.94 -108.98 2.42 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.597 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.72 -29.49 1.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.569 0.223 . . . . 0.0 111.489 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.525 ' O ' HG12 ' A' ' 604' ' ' VAL . 2.4 p -88.32 -177.04 5.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.188 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.588 ' HA ' HG12 ' A' ' 604' ' ' VAL . . . -160.68 133.04 6.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.977 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.2 m -119.01 110.35 17.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.072 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.552 HG13 HG23 ' A' ' 602' ' ' THR . 2.8 mp -103.48 124.34 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.825 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 70.3 m -109.06 168.09 9.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 79.89 52.21 4.76 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.666 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 17.2 mt -118.13 165.75 13.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -127.44 131.93 50.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.539 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -68.53 176.32 2.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.285 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 59.43 22.25 10.72 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.44 151.32 44.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.364 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 67.6 m -92.37 146.1 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.325 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -139.6 128.88 23.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.91 0.385 . . . . 0.0 111.702 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.03 134.99 46.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.835 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -128.65 163.42 25.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.373 0.606 . . . . 0.0 112.159 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.445 ' HG1' ' HB2' ' A' ' 595' ' ' TYR . 1.1 p -147.54 164.8 32.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.83 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.45 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -135.01 142.46 40.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 111.548 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.551 ' HD2' HG23 ' A' ' 633' ' ' VAL . 7.7 mttt -131.25 162.87 29.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.737 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.9 132.46 55.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.179 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -123.65 154.6 39.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.45 -179.91 3.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.894 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.95 -3.41 57.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -100.21 -0.09 39.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.025 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.27 35.25 15.12 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.652 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.452 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.5 m-80 -116.32 132.92 56.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 0.0 110.919 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.551 HG23 ' HD2' ' A' ' 625' ' ' LYS . 2.8 p -120.2 147.19 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.094 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.41 -152.05 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.579 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.35 174.15 7.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.967 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.477 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.13 130.74 36.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.124 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -178.71 1.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.017 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.76 150.48 36.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.749 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -90.07 125.08 35.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -102.39 150.63 6.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.774 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.83 125.97 54.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 6.4 p -127.4 134.99 64.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.934 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.1 111.84 24.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.934 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.539 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 22.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.15 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 19.0 m170 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.755 0.312 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.9 mmt 55.23 -160.14 0.18 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -62.26 150.78 83.7 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.423 ' HB3' HG21 ' A' ' 589' ' ' VAL . 57.2 Cg_endo -70.68 -152.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.508 2.138 . . . . 0.0 112.134 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.9 OUTLIER -116.55 125.72 52.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.927 179.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.428 ' HB1' ' H ' ' A' ' 635' ' ' ALA . . . -59.19 124.22 73.54 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.942 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.47 144.52 7.11 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.466 2.111 . . . . 0.0 112.105 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 51.2 p -132.66 155.44 48.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.401 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t30 58.76 64.46 1.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.447 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.808 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.0 tp -88.3 156.71 19.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.233 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.65 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.13 172.38 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.961 0.41 . . . . 0.0 111.589 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 40.1 p -118.18 128.96 55.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.354 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' THR . . . . . 0.617 ' HG1' ' HB ' ' A' ' 577' ' ' THR . 2.9 p -99.87 -87.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.521 -179.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.569 ' H ' ' HG1' ' A' ' 569' ' ' THR . . . -89.44 96.66 10.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 111.438 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.635 HE21 HG21 ' A' ' 644' ' ' THR . 1.9 tt0 -112.26 136.32 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.771 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.7 p -130.66 -162.14 1.19 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.096 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.4 p -91.86 6.66 45.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.451 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -135.95 -56.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.24 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.561 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 10.9 t -113.91 158.45 21.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.513 HD13 ' HG3' ' A' ' 571' ' ' GLN . 15.4 tt -142.0 136.33 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.617 ' HB ' ' HG1' ' A' ' 569' ' ' THR . 1.7 m -99.72 129.55 45.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.646 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.808 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -119.08 133.15 55.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.097 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 84.8 p -125.7 146.95 49.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.291 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.65 ' HB3' HD12 ' A' ' 566' ' ' LEU . 49.1 p90 -159.2 170.33 22.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.936 0.398 . . . . 0.0 111.379 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.33 133.18 36.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -71.0 174.66 5.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.07 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 t -83.2 149.37 26.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.877 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 3.9 p -75.43 -7.7 54.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.505 ' O ' HG22 ' A' ' 589' ' ' VAL . 72.9 m-20 -125.25 67.83 1.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.738 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.77 3.91 13.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.96 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.64 -12.22 15.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.047 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.75 -32.14 0.57 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.543 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 585' ' ' ASP . 11.1 t -61.13 150.39 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.733 0.302 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.11 -50.6 1.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.426 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -147.3 175.15 26.81 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.813 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -122.59 157.86 31.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.794 0.33 . . . . 0.0 110.978 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.68 120.88 16.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.53 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -101.25 137.16 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.955 0.407 . . . . 0.0 110.731 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 59.2 m-85 -104.07 147.85 26.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.75 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -99.69 84.29 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.132 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 598' ' ' THR . . . 88.11 -62.26 3.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.125 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 598' ' ' THR . . . . . 0.463 HG21 ' O ' ' A' ' 597' ' ' GLY . 0.9 OUTLIER -153.4 -20.7 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.994 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -96.07 163.63 13.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.915 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -80.05 118.14 21.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.722 0.296 . . . . 0.0 110.465 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -90.09 -106.38 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.939 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.0 t -91.1 167.68 12.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.103 0.477 . . . . 0.0 111.358 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.31 130.02 38.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.214 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.406 ' CG1' ' HA ' ' A' ' 609' ' ' ALA . 17.2 m -131.79 -178.8 2.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.581 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 65.6 p -135.67 -17.09 1.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -94.83 -139.08 9.8 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.01 16.92 19.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.291 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -133.89 170.38 15.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.053 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 577' ' ' THR . . . -148.55 140.93 24.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.849 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.435 HG21 ' OG ' ' A' ' 575' ' ' SER . 0.8 OUTLIER -125.95 113.13 16.76 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.476 -179.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -110.39 108.36 25.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.788 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.8 166.8 10.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.967 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 82.48 32.42 27.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.437 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 10.8 mt -92.83 166.95 12.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.857 0.36 . . . . 0.0 111.097 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -116.36 147.08 41.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.744 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -78.18 162.09 26.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.506 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 58.43 38.02 25.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.408 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.48 147.01 38.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.348 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.17 144.04 28.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.55 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -137.86 153.4 49.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 111.767 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.533 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -125.02 139.44 53.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.098 179.169 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.458 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 44.9 m-85 -132.75 152.07 51.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 112.327 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 45.4 p -146.57 128.51 15.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.659 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.581 ' H ' ' HG ' ' A' ' 637' ' ' SER . 0.0 OUTLIER -99.53 147.47 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 1.8 mttt -132.43 169.8 16.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.499 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.487 ' O ' HG23 ' A' ' 633' ' ' VAL . . . -128.08 130.88 48.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.867 0.365 . . . . 0.0 111.379 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -121.02 147.15 45.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.723 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.37 171.93 7.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.06 40.5 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.198 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -139.9 -41.44 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.076 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 142.1 -9.27 2.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.643 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -83.1 137.64 34.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 111.033 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 626' ' ' ALA . 0.8 OUTLIER -129.74 148.61 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.931 179.802 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.99 -164.11 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.428 ' H ' ' HB1' ' A' ' 562' ' ' ALA . . . -90.08 178.01 6.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.024 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -85.69 149.37 25.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.581 ' HG ' ' H ' ' A' ' 624' ' ' VAL . 0.8 OUTLIER -82.61 -175.8 5.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.896 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -62.2 160.84 12.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.2 131.65 39.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.533 ' O ' ' HA ' ' A' ' 621' ' ' THR . 13.6 p -115.59 134.05 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 8.3 t -104.99 130.24 53.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -117.05 150.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.973 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.64 88.74 2.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.635 HG21 HE21 ' A' ' 571' ' ' GLN . 51.4 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.121 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.692 0.282 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 54.68 -152.33 0.34 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -59.68 147.95 76.51 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.848 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.616 ' HD3' ' HB3' ' A' ' 628' ' ' ASP . 70.0 Cg_endo -73.41 -178.77 3.88 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.442 2.095 . . . . 0.0 112.319 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.61 154.71 36.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.528 ' HB1' ' O ' ' A' ' 635' ' ' ALA . . . -91.86 129.97 40.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.334 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.453 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 77.3 Cg_exo -50.12 151.4 9.1 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.511 2.141 . . . . 0.0 111.749 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 45.5 p -139.19 156.89 46.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 111.693 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.54 54.19 5.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.779 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.722 HD21 HG23 ' A' ' 624' ' ' VAL . 16.5 tp -82.38 156.27 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.682 0.277 . . . . 0.0 110.302 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.531 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.04 179.66 7.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.998 0.428 . . . . 0.0 111.67 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 93.2 p -126.75 123.17 36.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.178 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.6 -87.27 0.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.846 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -79.78 97.9 6.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.7 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -113.33 119.48 37.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.528 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 11.6 p -113.77 -161.02 0.75 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.006 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 30.1 p -91.46 20.55 5.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -167.68 -46.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.736 0.303 . . . . 0.0 111.405 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.5 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -105.77 130.69 53.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.216 -179.682 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . . . . . . . . . 17.1 tt -121.05 147.34 24.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.214 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 31.8 m -111.65 131.38 55.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.698 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.712 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.5 tp -121.66 130.44 53.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 11.1 t -126.76 136.59 52.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.68 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.463 ' CD2' HG12 ' A' ' 624' ' ' VAL . 40.9 p90 -150.98 170.41 19.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.837 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.8 m -79.39 127.35 31.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.7 133.31 55.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.94 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.1 m -72.04 151.92 42.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -177.51 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 54.63 53.4 10.69 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.92 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -65.76 -10.33 36.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.882 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.5 m -66.68 -10.22 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.258 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -125.28 -34.8 0.65 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.552 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 627' ' ' LYS . 2.8 t -65.7 130.27 30.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 111.048 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.01 -23.06 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.181 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -175.9 178.22 47.44 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.65 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -126.03 126.31 44.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.826 0.346 . . . . 0.0 111.014 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.75 118.7 37.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.54 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.81 130.62 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.503 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.5 m-85 -99.67 154.51 18.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.677 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -136.47 90.22 2.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.499 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 70.19 59.55 5.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.148 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.6 p 53.58 40.49 31.49 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.962 0.41 . . . . 0.0 111.393 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.84 111.44 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.907 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -48.6 124.28 8.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.336 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -100.75 -106.39 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.081 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.509 ' HG1' ' H ' ' A' ' 603' ' ' THR . 9.5 t -91.02 167.67 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.139 0.495 . . . . 0.0 111.525 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.509 ' H ' ' HG1' ' A' ' 602' ' ' THR . 6.6 m -131.78 129.02 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.376 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.555 HG12 ' HA ' ' A' ' 609' ' ' ALA . 14.9 m -130.32 -170.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.528 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.595 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.9 p -145.65 -26.69 0.46 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.97 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -79.03 -113.42 0.22 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.913 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.4 p -139.14 3.65 2.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.736 0.303 . . . . 0.0 111.241 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 41.1 p -129.46 146.34 51.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.555 ' HA ' HG12 ' A' ' 604' ' ' VAL . . . -124.06 136.02 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.031 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.34 129.47 54.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 575' ' ' SER . 2.7 mp -125.45 119.53 55.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.065 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.99 131.44 55.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.007 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 115.99 60.1 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.625 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.5 mt -129.61 173.89 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.724 0.297 . . . . 0.0 110.698 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -132.3 145.01 50.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.74 173.31 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.172 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 55.34 38.17 29.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 618' ' ' THR . . . . . 0.413 HG22 ' H ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -137.64 161.43 36.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.399 -179.981 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 619' ' ' SER . . . . . 0.413 ' H ' HG22 ' A' ' 618' ' ' THR . 3.2 m -119.99 127.46 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.591 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -123.89 149.49 45.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.997 0.427 . . . . 0.0 111.215 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 44.5 p -124.3 106.13 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.395 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.457 ' O ' HG21 ' A' ' 640' ' ' VAL . 94.5 m-85 -100.0 157.75 16.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.212 0.53 . . . . 0.0 111.749 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.449 HG21 ' O ' ' A' ' 622' ' ' PHE . 1.5 p -152.38 134.66 15.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.731 179.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.722 HG23 HD21 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.37 141.1 17.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.277 0.561 . . . . 0.0 111.975 -179.158 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.581 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -130.03 152.21 49.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.551 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.15 144.26 39.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.466 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -122.12 176.71 5.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.543 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.616 ' HB3' ' HD3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -138.45 172.15 13.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.84 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.82 42.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.368 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -150.16 -6.69 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.165 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 93.13 35.52 6.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.444 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -119.17 138.91 52.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 35.5 m -114.65 151.6 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.481 ' OG ' ' HG2' ' A' ' 560' ' ' PRO . 0.7 OUTLIER -90.33 -157.78 0.5 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.394 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.528 ' O ' ' HB1' ' A' ' 562' ' ' ALA . . . -88.76 156.96 18.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.791 0.329 . . . . 0.0 110.652 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.581 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.05 116.01 19.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.821 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.84 173.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.162 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -58.03 147.49 29.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.417 ' HA ' HG21 ' A' ' 623' ' ' THR . . . -80.45 139.92 36.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.076 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.457 HG21 ' O ' ' A' ' 622' ' ' PHE . 2.6 m -116.51 103.57 15.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.968 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 14.5 t -83.6 106.32 15.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.862 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 10.9 p -109.07 145.12 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.157 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.441 ' HE2' ' O ' ' A' ' 644' ' ' THR . 0.2 OUTLIER -120.29 111.49 17.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.722 179.73 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.441 ' O ' ' HE2' ' A' ' 643' ' ' LYS . 69.6 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.259 -0.876 . . . . 0.0 111.18 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 . . . . . 0 N--CA 1.488 1.425 0 CA-C-O 120.717 0.294 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.4 22.57 6.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.447 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -64.37 148.86 95.66 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.018 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.81 -163.97 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.54 2.16 . . . . 0.0 112.343 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 583' ' ' SER . 5.0 m -100.29 124.63 45.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.101 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 635' ' ' ALA . . . -62.97 129.65 93.48 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.467 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 85.0 Cg_exo -45.78 151.89 1.18 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.911 2.407 . . . . 0.0 112.295 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.2 p -136.17 155.49 50.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.9 0.381 . . . . 0.0 111.534 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 59.5 t30 57.23 67.47 0.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.576 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.789 HD11 ' HG ' ' A' ' 578' ' ' LEU . 15.2 tp -86.69 159.31 19.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.0 179.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.573 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.89 167.37 26.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.985 0.421 . . . . 0.0 111.888 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 4.6 p -121.23 146.65 46.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.334 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.1 p -125.98 -86.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.446 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.433 ' O ' ' HA ' ' A' ' 576' ' ' ILE . . . -82.15 97.93 8.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.194 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.98 95.28 4.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -84.45 -154.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.185 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.49 -11.55 39.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.69 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.7 p -136.82 -40.18 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.64 162.45 13.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.176 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 610' ' ' THR . 17.4 tt -156.46 149.32 10.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.862 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 10.4 m -119.04 140.06 50.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.75 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.789 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -124.06 149.65 45.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.86 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 9.7 t -142.74 131.27 22.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.211 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.473 ' CZ2' HG13 ' A' ' 624' ' ' VAL . 43.5 p90 -149.56 169.65 20.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.204 -179.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 m -79.89 143.61 34.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.961 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.44 170.18 0.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.441 ' O ' ' HB ' ' A' ' 561' ' ' THR . 2.2 p -69.87 -5.4 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.53 16.45 5.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -152.49 72.11 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.675 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.472 ' HB2' ' H ' ' A' ' 587' ' ' VAL . 0.2 OUTLIER -70.24 -128.87 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.721 -179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.472 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 4.2 m 44.1 26.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.119 0.485 . . . . 0.0 111.723 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -176.87 -37.62 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.918 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.67 144.4 13.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.564 0.221 . . . . 0.0 110.559 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.3 t -132.43 -30.11 1.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.722 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.49 172.41 30.98 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.011 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -130.93 134.87 47.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.691 0.281 . . . . 0.0 110.647 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -99.99 128.45 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.796 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.609 ' HB ' HG21 ' A' ' 602' ' ' THR . 61.6 t -99.66 132.51 44.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.979 0.419 . . . . 0.0 111.308 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.707 ' HB2' ' HG1' ' A' ' 623' ' ' THR . 52.2 m-85 -101.31 124.66 47.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.928 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.459 ' HB2' ' HB1' ' A' ' 601' ' ' ALA . 47.6 t30 -100.06 84.61 2.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . 0.428 ' O ' HG22 ' A' ' 598' ' ' THR . . . 95.92 -80.8 0.79 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.277 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 598' ' ' THR . . . . . 0.428 HG22 ' O ' ' A' ' 597' ' ' GLY . 4.5 p -147.18 16.98 1.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.783 0.325 . . . . 0.0 111.072 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -145.35 173.05 12.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -71.07 149.93 46.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.825 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.459 ' HB1' ' HB2' ' A' ' 596' ' ' ASN . . . -132.92 -100.94 0.26 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.342 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.609 HG21 ' HB ' ' A' ' 594' ' ' VAL . 14.0 t -90.13 172.65 8.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.916 0.388 . . . . 0.0 111.428 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 80.1 m -140.34 126.07 19.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.858 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.463 HG13 ' HA ' ' A' ' 609' ' ' ALA . 7.0 m -126.36 -177.09 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.528 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.722 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 67.4 p -137.89 -11.34 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.27 -126.52 5.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.464 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 4.4 p -122.72 -4.39 8.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.749 0.309 . . . . 0.0 111.059 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.423 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 17.2 p -111.23 173.59 6.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.024 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.463 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -155.45 127.74 7.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.075 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.9 m -114.14 112.91 23.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.157 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.594 HG13 HG22 ' A' ' 602' ' ' THR . 4.9 mp -105.94 131.9 54.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.937 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 15.9 p -120.89 173.73 7.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.106 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 74.8 44.47 24.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.727 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.3 mt -117.7 132.52 56.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.818 0.342 . . . . 0.0 110.825 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.02 143.88 35.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.59 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -74.96 167.38 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.133 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.21 35.06 25.72 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.8 m -137.51 146.43 44.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.232 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.83 136.88 32.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -135.76 140.36 44.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 111.615 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 2.0 p -111.97 135.02 53.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.532 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.636 ' H ' HG11 ' A' ' 640' ' ' VAL . 54.5 m-85 -126.45 161.27 28.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.279 0.562 . . . . 0.0 112.396 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.707 ' HG1' ' HB2' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -160.26 159.11 31.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.768 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.473 HG13 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -124.14 152.61 29.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.047 0.451 . . . . 0.0 111.497 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 3.8 mttt -139.15 139.36 37.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.803 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.495 ' HB2' ' OG ' ' A' ' 634' ' ' SER . . . -94.96 116.42 28.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.0 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -108.71 148.59 30.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.104 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -116.19 169.92 8.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.773 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.64 -13.84 59.62 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.159 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -83.8 5.62 24.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.046 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.03 2.86 90.68 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.404 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.447 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 34.3 m-20 -95.81 123.47 39.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.761 0.315 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.5 p -120.91 136.79 56.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.495 ' OG ' ' HB2' ' A' ' 626' ' ' ALA . 1.9 p -69.03 -167.51 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.952 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.468 ' O ' ' HB3' ' A' ' 562' ' ' ALA . . . -89.3 -178.46 5.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.751 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.522 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.16 146.0 28.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.6 p -82.64 -164.13 0.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.7 146.63 54.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.617 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.416 ' HA ' HG21 ' A' ' 623' ' ' THR . . . -79.69 148.68 31.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.916 0.388 . . . . 0.0 111.163 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.636 HG11 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -114.7 158.46 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.767 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 641' ' ' SER . . . . . 0.407 ' N ' HG12 ' A' ' 640' ' ' VAL . 44.7 t -143.94 105.52 4.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.769 179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.87 140.01 48.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.098 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.09 102.02 9.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.672 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.59 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 75.1 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.139 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.646 0.26 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.72 105.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.116 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -56.3 159.42 6.24 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.232 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -65.48 -169.06 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.603 2.202 . . . . 0.0 112.396 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.44 ' HG1' ' HB2' ' A' ' 585' ' ' ASP . 0.2 OUTLIER -88.95 118.12 28.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.126 179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.531 ' HB1' ' N ' ' A' ' 635' ' ' ALA . . . -60.17 127.29 85.84 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 88.4 Cg_exo -46.87 156.66 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.701 2.267 . . . . 0.0 112.034 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.52 159.32 40.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.449 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 60.0 49.94 7.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.287 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.795 HD13 ' HG ' ' A' ' 578' ' ' LEU . 56.9 tp -74.07 159.67 32.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.424 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.511 ' H ' HD11 ' A' ' 566' ' ' LEU . . . -161.33 -176.81 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.435 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 35.3 p -133.89 130.59 38.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.332 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.5 p -104.09 -85.29 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.454 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.81 103.56 14.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.05 116.94 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.809 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -108.68 -161.43 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.081 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.54 16.98 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 1.8 p -161.63 -43.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.186 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.7 167.11 10.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.633 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . . . . . . . . . 18.3 tt -160.44 147.31 5.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.907 0.384 . . . . 0.0 111.27 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.4 m -116.55 134.41 54.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.642 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.795 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -118.76 133.94 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.082 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.32 132.98 48.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.431 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.438 ' HB3' HD12 ' A' ' 566' ' ' LEU . 36.8 p90 -148.29 169.74 19.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.175 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 7.2 m -81.32 115.57 20.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.979 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.1 154.24 19.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.329 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 84.0 p -61.28 132.96 55.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.894 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -19.91 61.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.222 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.44 ' HB2' ' HG1' ' A' ' 561' ' ' THR . 1.3 m-20 -89.38 53.58 2.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.479 ' C ' ' H ' ' A' ' 588' ' ' GLY . 42.0 p-10 -72.54 -150.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 71.53 -17.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -132.66 -26.8 0.63 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.88 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 83.4 t -66.87 145.25 13.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.725 0.297 . . . . 0.0 110.81 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.539 HG21 ' HB3' ' A' ' 629' ' ' ALA . 0.7 OUTLIER -99.4 -67.09 0.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.48 -179.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -143.61 -173.06 14.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.931 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -125.84 130.85 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 110.876 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -110.26 120.75 43.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.662 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.622 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.68 136.16 32.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.906 0.384 . . . . 0.0 110.764 179.988 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -99.35 174.97 6.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.157 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -140.63 84.43 1.95 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.357 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.06 -66.22 3.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.233 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.11 31.76 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.859 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.65 137.06 11.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.068 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.66 136.22 54.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.202 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -109.74 -104.3 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.969 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.613 HG23 HG13 ' A' ' 611' ' ' ILE . 6.7 t -90.44 163.09 14.79 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.079 0.466 . . . . 0.0 111.344 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.5 m -126.95 131.55 51.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.616 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.499 HG11 ' O ' ' A' ' 608' ' ' THR . 16.5 m -135.71 -179.92 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 44.2 p -136.87 -5.79 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.45 -124.16 5.32 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.585 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 80.5 p -129.48 9.76 5.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.733 0.302 . . . . 0.0 111.063 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.543 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 23.2 p -136.47 138.84 41.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.194 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.414 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.47 155.86 36.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.2 m -129.76 125.3 35.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.16 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.613 HG13 HG23 ' A' ' 602' ' ' THR . 2.5 mt -121.68 119.61 59.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -107.42 173.64 6.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.03 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.66 59.09 8.05 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.612 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.4 mt -119.01 114.03 21.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.713 0.292 . . . . 0.0 111.005 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -65.21 133.67 52.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.526 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -67.15 173.18 3.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.197 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.69 35.32 25.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.049 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.3 m -140.36 142.92 35.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.459 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 t -99.95 111.92 24.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -105.25 127.6 53.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.552 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.694 HG23 ' HB1' ' A' ' 639' ' ' ALA . 0.1 OUTLIER -104.44 109.87 21.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.255 179.122 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -102.19 161.71 13.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.331 0.586 . . . . 0.0 112.222 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.4 p -150.83 148.87 29.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.524 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.622 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -110.14 151.64 12.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.052 0.453 . . . . 0.0 111.784 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -139.93 150.18 44.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.006 -179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.477 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -112.17 121.84 46.07 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.898 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.44 158.42 22.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.25 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.03 171.12 8.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . 0.539 ' HB3' HG21 ' A' ' 590' ' ' THR . . . -89.75 60.53 5.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.108 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -158.92 -43.78 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.68 16.37 0.61 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.496 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -111.99 125.11 53.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.339 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 28.4 m -119.67 142.65 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.355 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 31.7 p -77.68 -172.68 2.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.766 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.531 ' N ' ' HB1' ' A' ' 562' ' ' ALA . . . -79.01 167.95 20.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.843 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -87.3 128.99 35.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.066 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.511 ' HG ' ' H ' ' A' ' 638' ' ' ASN . 1.5 t -65.7 179.49 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.511 ' H ' ' HG ' ' A' ' 637' ' ' SER . 0.2 OUTLIER -64.61 157.6 26.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.727 179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.694 ' HB1' HG23 ' A' ' 621' ' ' THR . . . -89.24 138.5 31.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.16 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.02 108.63 25.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.044 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.08 111.77 17.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.38 129.04 74.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -101.82 115.79 31.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.526 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 35.9 p . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.4 m80 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.736 0.303 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 54.92 50.97 14.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.787 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -55.85 154.13 14.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.324 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.32 -158.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.6 2.2 . . . . 0.0 112.42 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 5.3 m -114.31 125.32 53.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.995 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.487 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.2 122.88 66.79 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.04 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.436 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.0 Cg_exo -48.42 159.33 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.539 2.159 . . . . 0.0 112.109 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' THR . . . . . 0.512 HG23 ' HG1' ' A' ' 581' ' ' THR . 0.0 OUTLIER -157.6 169.97 23.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.838 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.451 ' H ' ' HG1' ' A' ' 564' ' ' THR . 5.5 m-80 59.03 40.46 22.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.798 HD13 ' HG ' ' A' ' 578' ' ' LEU . 66.2 tp -66.79 157.41 32.97 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.725 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -162.36 -179.38 6.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.7 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 6.4 p -134.9 122.54 22.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.077 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.6 p -100.78 -88.2 0.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.745 0.307 . . . . 0.0 111.65 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.663 ' HB1' ' HG1' ' A' ' 577' ' ' THR . . . -84.22 100.36 11.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.276 -179.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.623 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.1 OUTLIER -118.48 114.15 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.745 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 13.2 p -100.77 -156.87 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.06 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.59 22.45 9.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.363 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 68.0 p -160.02 -49.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.454 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -113.28 131.08 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.024 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.623 HG13 ' HB2' ' A' ' 571' ' ' GLN . 17.2 tt -118.6 146.1 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.087 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.663 ' HG1' ' HB1' ' A' ' 570' ' ' ALA . 31.6 m -104.5 138.77 40.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.755 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.798 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -126.37 133.94 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.3 t -128.47 143.06 50.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.523 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.436 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 41.4 p90 -158.33 169.57 24.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.851 0.358 . . . . 0.0 111.169 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' THR . . . . . 0.512 ' HG1' HG23 ' A' ' 564' ' ' THR . 73.5 p -80.08 114.51 19.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.162 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.9 158.76 6.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.149 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.26 147.55 44.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.96 -5.61 49.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -126.35 73.27 1.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -85.31 18.87 2.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.3 p -81.14 -15.06 12.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.37 -24.31 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.608 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 11.8 t -61.67 143.51 14.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.774 0.321 . . . . 0.0 111.207 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 4.7 t -113.48 -15.98 12.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 171.24 -174.54 44.91 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.718 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -131.04 128.85 41.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.075 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.48 ' OD1' HG22 ' A' ' 603' ' ' THR . 4.2 m-20 -111.14 117.8 34.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.427 ' H ' HG11 ' A' ' 594' ' ' VAL . 0.2 OUTLIER -99.34 139.0 22.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.999 0.428 . . . . 0.0 111.103 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.484 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.2 m-85 -99.4 150.29 22.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.231 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -113.7 84.53 2.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.961 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.82 -65.45 1.19 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.093 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -154.74 -27.04 0.12 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.755 0.312 . . . . 0.0 111.152 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -100.01 153.07 19.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 600' ' ' LEU . 1.5 tm? -58.25 131.34 50.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.937 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.35 -105.96 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.625 HG23 HG13 ' A' ' 611' ' ' ILE . 3.8 t -90.49 166.68 13.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.954 0.407 . . . . 0.0 111.416 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.483 ' H ' ' HG1' ' A' ' 602' ' ' THR . 53.9 m -130.32 124.32 32.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.445 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.2 m -130.59 -177.68 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.293 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.457 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 50.6 p -142.4 -0.86 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -111.79 -144.78 9.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.669 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.6 25.1 11.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.752 0.31 . . . . 0.0 111.168 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.43 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -147.27 162.58 38.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.445 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.6 149.99 36.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.737 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 5.1 m -132.45 118.01 18.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.625 HG13 HG23 ' A' ' 602' ' ' THR . 4.5 mp -99.55 136.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.692 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 612' ' ' SER . . . . . 0.468 ' N ' HG23 ' A' ' 611' ' ' ILE . 0.3 OUTLIER -99.84 -172.21 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.962 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.21 -103.29 0.77 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 1.1 mp 57.86 177.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.027 0.442 . . . . 0.0 111.537 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -169.82 129.22 0.96 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.927 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -55.12 163.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.4 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.54 31.96 21.61 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.234 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.2 148.17 41.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.904 0.383 . . . . 0.0 111.432 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.49 140.13 38.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.515 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -134.89 130.18 35.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.315 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 38.3 p -105.39 108.33 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.149 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.479 ' O ' HG21 ' A' ' 623' ' ' THR . 70.1 m-85 -99.9 160.2 14.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.272 0.558 . . . . 0.0 112.085 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.492 HG22 ' O ' ' A' ' 637' ' ' SER . 1.3 p -154.08 136.07 14.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.814 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.45 HG21 HD12 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.41 151.94 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.012 0.434 . . . . 0.0 111.661 -179.346 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.484 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 8.4 mmtt -140.42 134.03 30.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.095 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.413 ' HB1' ' OG ' ' A' ' 634' ' ' SER . . . -92.77 123.41 36.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -117.98 143.86 46.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.041 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.484 ' OD1' ' HB2' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -110.5 160.05 16.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.859 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.31 57.59 4.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.093 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . 0.484 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . . . -157.96 -39.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 133.44 32.35 0.39 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.732 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -122.53 100.62 7.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.784 0.326 . . . . 0.0 111.061 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.3 t -99.87 119.02 47.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.413 ' OG ' ' HB1' ' A' ' 626' ' ' ALA . 24.8 p -67.29 -173.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.979 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.487 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.97 166.4 21.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.274 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.45 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.38 142.7 32.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.492 ' O ' HG22 ' A' ' 623' ' ' THR . 0.3 OUTLIER -74.65 175.55 7.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.044 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.471 HD22 ' H ' ' A' ' 566' ' ' LEU . 3.7 p30 -60.29 150.94 28.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.592 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.87 137.57 36.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -116.94 112.31 38.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.913 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 15.2 t -89.15 109.34 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.0 144.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.84 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.845 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.135 -179.988 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.721 0.296 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.49 40.55 31.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.859 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -60.61 152.95 64.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -68.52 -169.82 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.407 2.071 . . . . 0.0 112.354 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 59.2 m -87.19 120.29 28.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.492 ' HB3' ' N ' ' A' ' 635' ' ' ALA . . . -63.15 129.55 93.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.107 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.582 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 71.0 Cg_exo -48.01 160.61 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.681 2.254 . . . . 0.0 112.173 179.74 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.0 t -145.47 163.69 33.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.309 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 59.68 34.27 22.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.715 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.694 HD13 HG13 ' A' ' 640' ' ' VAL . 2.3 tm? -62.95 119.53 9.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.258 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -147.61 152.08 37.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 111.334 -179.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.1 p -93.78 137.76 32.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.2 p -107.49 -87.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.53 108.38 19.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.885 179.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.03 134.55 54.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.141 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.5 p -108.49 -157.2 0.61 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.865 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -91.38 -12.23 35.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.324 -179.813 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 98.0 p -130.62 -44.87 1.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.298 -179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -101.47 170.78 7.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.03 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.465 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.3 tt -160.44 146.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 87.8 m -118.41 114.04 22.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.824 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.469 HD21 HD22 ' A' ' 566' ' ' LEU . 9.3 mt -101.69 137.76 39.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.068 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 24.5 p -125.59 143.84 50.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.437 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.473 ' CE2' HG12 ' A' ' 624' ' ' VAL . 46.5 p90 -155.32 169.72 23.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.365 . . . . 0.0 111.124 -179.704 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.63 139.26 32.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.36 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.63 179.17 2.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.217 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 t -80.92 138.61 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 53.3 p -74.07 -1.14 18.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -105.34 -67.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.809 179.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.652 ' HA ' HG21 ' A' ' 589' ' ' VAL . 46.7 t30 56.79 24.24 8.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 m -89.29 27.06 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.039 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . 167.34 -9.33 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.41 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.652 HG21 ' HA ' ' A' ' 586' ' ' ASN . 3.6 t -66.46 153.65 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -52.17 0.76 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.419 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.651 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -134.98 179.9 17.18 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.813 -179.836 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -134.75 121.62 20.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.515 ' HB3' HD12 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -100.89 126.2 47.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.6 179.757 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.66 142.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.924 0.393 . . . . 0.0 111.266 -179.495 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 81.0 m-85 -106.0 151.73 24.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.317 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -140.7 97.19 3.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.039 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 56.9 71.59 0.71 Allowed Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.627 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.2 p 47.62 31.07 1.93 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.813 0.339 . . . . 0.0 111.571 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.99 110.3 2.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.775 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.557 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.6 tt -52.22 133.92 33.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.332 -179.647 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.448 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -97.98 -100.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.559 ' HG1' ' H ' ' A' ' 603' ' ' THR . 14.4 t -90.84 167.53 12.38 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.201 0.524 . . . . 0.0 111.436 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.559 ' H ' ' HG1' ' A' ' 602' ' ' THR . 7.6 m -135.33 117.24 15.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.522 179.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 18.6 m -117.65 -172.55 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.636 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.651 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 6.1 p -143.23 -2.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.14 -117.66 4.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.479 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -16.77 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.696 0.284 . . . . 0.0 111.315 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 74.5 p -108.02 167.87 9.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.942 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -152.32 128.23 10.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.046 179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.4 m -108.66 119.51 39.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.272 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.465 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.5 mp -108.48 138.21 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.3 p -121.13 175.59 6.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.898 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.09 61.51 5.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.667 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 9.5 mt -131.2 124.78 31.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 110.816 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -77.5 140.21 39.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.447 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -72.98 164.55 26.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.167 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.06 44.59 25.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.057 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.6 m -139.98 149.78 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -86.17 134.65 33.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.549 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -132.75 152.77 51.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.215 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -137.75 104.68 5.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.202 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.502 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 78.5 m-85 -100.52 176.49 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.292 0.568 . . . . 0.0 112.12 -178.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.403 HG21 ' O ' ' A' ' 637' ' ' SER . 0.1 OUTLIER -173.73 168.72 4.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.71 179.641 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.473 HG12 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -131.16 151.36 35.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.068 0.461 . . . . 0.0 111.634 -179.899 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.522 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 8.9 mmtt -140.7 123.24 16.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.151 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.582 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -79.42 132.88 36.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.096 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -119.97 144.99 47.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.779 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -107.57 166.83 10.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.127 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.24 34.65 0.74 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.191 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -140.11 4.74 2.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.058 -179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.93 30.99 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.773 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.84 124.74 52.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.665 0.269 . . . . 0.0 110.788 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 12.4 p -116.45 134.53 59.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 111.244 179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.468 ' HG ' ' HA ' ' A' ' 562' ' ' ALA . 21.4 p -76.89 -166.11 0.64 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.707 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.492 ' N ' ' HB3' ' A' ' 562' ' ' ALA . . . -87.69 173.03 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.895 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.522 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -86.49 133.88 33.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.2 -179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.403 ' O ' HG21 ' A' ' 623' ' ' THR . 0.3 OUTLIER -63.46 178.74 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.922 179.783 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.01 149.23 19.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.384 179.601 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.64 129.0 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.429 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.694 HG13 HD13 ' A' ' 566' ' ' LEU . 7.9 p -108.38 140.73 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.95 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 641' ' ' SER . . . . . 0.403 ' N ' HG23 ' A' ' 640' ' ' VAL . 0.3 OUTLIER -106.52 102.87 12.23 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.396 179.728 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.401 HG22 ' CD1' ' A' ' 576' ' ' ILE . 47.2 t -99.31 114.33 37.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.248 -179.494 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.07 101.07 10.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.613 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.447 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 68.3 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.201 -179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 10.9 p80 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.856 0.36 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.7 -162.83 0.82 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.882 -179.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.46 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -60.58 146.48 85.39 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.002 -179.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.32 -159.72 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.457 2.105 . . . . 0.0 112.101 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.443 ' HG1' ' HG ' ' A' ' 583' ' ' SER . 0.3 OUTLIER -110.1 134.59 52.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.208 -179.854 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.56 128.82 93.85 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.454 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 83.3 Cg_exo -45.23 136.65 10.88 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.697 2.265 . . . . 0.0 112.074 179.578 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.9 p -119.05 149.67 41.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.7 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 10.0 m120 55.94 61.96 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.483 179.468 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.619 HD11 ' HB3' ' A' ' 580' ' ' TRP . 33.1 tp -65.71 159.17 25.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.298 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.511 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.03 177.24 10.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.035 0.445 . . . . 0.0 111.636 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 568' ' ' SER . . . . . 0.458 ' HB2' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -133.6 150.74 51.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.465 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -120.52 -90.35 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.447 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.0 97.26 11.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.229 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.458 ' NE2' ' HB2' ' A' ' 568' ' ' SER . 1.5 mp0 -113.72 102.71 10.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.828 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 8.6 p -88.17 -162.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.239 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.65 19.0 7.89 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.661 -179.569 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.528 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 8.9 p -158.89 -44.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.79 0.329 . . . . 0.0 111.204 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 65.3 p -113.92 122.2 46.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.413 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 18.1 tt -109.17 138.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.168 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 14.3 m -112.9 116.11 29.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 59.5 mt -103.73 156.5 17.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.947 0.403 . . . . 0.0 111.182 -179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.1 p -145.0 138.91 27.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.04 179.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.619 ' HB3' HD11 ' A' ' 566' ' ' LEU . 41.8 p90 -144.8 169.83 17.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.971 0.415 . . . . 0.0 111.52 -179.34 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -80.53 126.65 31.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.144 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.21 163.4 4.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.462 ' HG ' ' H ' ' A' ' 585' ' ' ASP . 1.6 t -88.08 133.06 34.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -8.16 37.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.183 179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.462 ' H ' ' HG ' ' A' ' 583' ' ' SER . 1.1 m-20 -100.1 54.98 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.958 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -71.15 -135.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.674 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.1 t 52.6 20.6 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 121.119 0.485 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -171.1 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.851 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 57.8 t -65.25 117.55 6.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.764 0.316 . . . . 0.0 110.422 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.0 t -101.06 -35.41 9.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.541 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -158.03 178.44 34.31 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.216 -0.992 . . . . 0.0 113.223 -179.616 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 626' ' ' ALA . 90.6 m-85 -124.94 155.13 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.763 0.315 . . . . 0.0 110.857 -179.998 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -131.39 117.8 19.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.422 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.508 HG21 ' N ' ' A' ' 595' ' ' TYR . 0.2 OUTLIER -99.68 143.81 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.916 0.388 . . . . 0.0 111.289 -179.575 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.574 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 92.1 m-85 -108.97 156.2 19.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.45 -179.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -118.19 84.04 2.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.152 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.51 -51.43 4.4 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.209 -179.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.11 -43.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 0.0 111.125 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -80.06 172.39 13.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.2 tp -90.79 126.98 36.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.322 179.198 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.43 -107.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.859 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.459 HG21 HG13 ' A' ' 611' ' ' ILE . 2.9 t -91.54 164.95 13.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.216 0.532 . . . . 0.0 111.495 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -131.06 106.74 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.332 179.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 34.6 m -111.15 -177.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.638 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.541 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.5 p -137.47 -20.08 1.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.795 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -81.15 -116.04 0.37 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.719 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.63 -5.12 2.88 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 -179.653 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 1.7 p -122.2 156.86 32.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.199 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -134.53 129.74 35.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.032 179.958 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.4 m -110.02 125.99 53.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.188 -179.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.459 HG13 HG21 ' A' ' 602' ' ' THR . 2.9 mp -111.04 136.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.955 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 82.2 p -113.88 178.0 4.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.24 36.19 92.91 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.447 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.7 OUTLIER -87.88 -174.23 4.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 110.992 -179.903 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -147.29 158.04 43.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -88.91 157.32 18.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.213 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.66 43.37 28.22 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.089 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 10.7 m -140.31 144.13 36.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.457 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.9 p -90.58 140.48 29.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.262 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -135.12 122.66 22.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.828 0.347 . . . . 0.0 111.711 -179.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -102.88 105.51 15.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.91 178.852 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -100.17 176.38 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.399 0.618 . . . . 0.0 112.442 -178.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.18 155.5 5.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.619 179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.454 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -119.45 159.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.932 0.396 . . . . 0.0 111.538 -179.743 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.574 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mmtt -140.75 113.34 8.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.211 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.501 ' HB3' ' CE2' ' A' ' 592' ' ' TYR . . . -79.51 119.39 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.52 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.83 166.43 12.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.784 179.817 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.15 164.23 20.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.61 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.63 57.38 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.97 -19.02 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.082 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 113.09 26.15 4.18 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.269 -179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 4.4 m120 -121.81 121.25 36.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.748 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 634' ' ' SER . 2.3 p -138.91 134.59 42.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.225 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.445 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.19 -176.5 3.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.828 179.908 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.469 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -74.68 176.17 7.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.044 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.552 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -73.54 154.72 39.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.078 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.3 p -79.85 -163.27 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.758 -179.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.79 146.99 41.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.98 23.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.928 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.5 p -102.9 134.53 43.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.262 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.5 m -109.32 105.92 15.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.337 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.24 130.32 63.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.417 ' O ' ' HG3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -96.45 121.66 38.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.102 -179.75 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . 0.43 ' ND1' ' H3 ' ' A' ' 557' ' ' HIS . 33.5 p-80 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.595 0.236 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 5.8 ttm 64.79 135.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.405 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.452 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -70.94 152.39 94.99 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.108 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.22 -165.76 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.642 2.228 . . . . 0.0 112.237 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.33 150.69 19.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.765 179.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.535 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -84.11 125.95 71.19 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.416 -179.748 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.617 ' HB2' ' HG ' ' A' ' 637' ' ' SER . 81.2 Cg_exo -48.31 154.57 2.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.686 2.257 . . . . 0.0 112.009 179.476 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.26 163.08 33.95 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.07 0.462 . . . . 0.0 111.664 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.94 52.74 11.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.06 179.122 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.662 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 2.0 tp -74.23 156.95 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.051 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.662 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 -177.99 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.518 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 83.9 p -133.76 129.04 36.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.653 179.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 76.1 p -111.43 -72.53 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.383 -179.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.26 96.3 10.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.351 . . . . 0.0 110.905 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.533 ' HA ' ' HA ' ' A' ' 576' ' ' ILE . 0.7 OUTLIER -123.39 105.64 9.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 17.0 p -85.69 -155.2 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.919 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.0 m -88.04 -37.34 16.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 16.0 p -115.0 -2.61 12.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.669 0.271 . . . . 0.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.99 165.41 25.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.954 179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.681 HG21 HD11 ' A' ' 611' ' ' ILE . 16.4 tt -160.06 148.71 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.9 m -132.66 124.03 27.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.659 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 566' ' ' LEU . 23.7 mt -107.47 153.28 23.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.398 . . . . 0.0 111.486 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.7 t -133.38 135.23 44.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.051 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.477 ' HB3' HD13 ' A' ' 566' ' ' LEU . 46.5 p90 -143.48 169.89 16.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.473 -179.268 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 m -82.05 115.87 21.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.213 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -62.55 157.25 20.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.018 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.6 146.29 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.757 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 74.5 p -82.56 20.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.126 179.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.437 ' O ' HG22 ' A' ' 589' ' ' VAL . 9.2 m-20 -140.17 71.32 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.696 179.918 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.94 22.25 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -85.45 6.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -155.85 -25.67 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.401 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 585' ' ' ASP . 16.8 t -66.26 140.53 19.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.83 0.348 . . . . 0.0 111.173 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 22.3 p -115.48 -51.49 2.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.17 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.555 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -144.24 179.55 21.45 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.597 -179.947 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -131.28 120.36 23.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 111.016 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -99.75 122.17 42.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.419 179.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.534 HG11 HG22 ' A' ' 602' ' ' THR . 0.1 OUTLIER -102.01 138.17 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.971 0.415 . . . . 0.0 111.267 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.73 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 96.1 m-85 -99.27 162.04 13.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.655 179.912 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -140.32 88.96 2.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 62.55 69.02 1.42 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.995 -179.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p 50.23 35.02 9.59 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.008 0.432 . . . . 0.0 111.115 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.31 102.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.775 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.689 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -48.87 122.99 6.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.291 -179.654 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -92.89 -98.95 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.198 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.534 HG22 HG11 ' A' ' 594' ' ' VAL . 9.4 t -90.8 169.07 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.133 0.492 . . . . 0.0 111.669 -179.778 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.16 109.07 6.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.455 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.493 HG13 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -108.42 -170.59 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.789 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.555 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 32.0 p -140.51 2.47 1.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.834 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.1 -134.05 5.56 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.475 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 52.5 p -112.5 -4.03 14.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.768 0.318 . . . . 0.0 111.238 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.509 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 1.4 p -119.1 152.75 35.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.122 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.525 ' O ' ' HA ' ' A' ' 577' ' ' THR . . . -136.26 124.02 22.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 9.2 m -106.56 134.41 49.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.347 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.681 HD11 HG21 ' A' ' 576' ' ' ILE . 4.4 mp -121.01 138.6 50.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 612' ' ' SER . . . . . 0.487 ' N ' HG21 ' A' ' 611' ' ' ILE . 14.1 m -117.76 162.36 18.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.793 179.907 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.49 79.1 0.22 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.321 -179.761 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 1.2 tp -135.18 154.86 51.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 111.081 -179.755 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . 0.487 ' HB3' ' HG1' ' A' ' 618' ' ' THR . . . -92.05 163.36 14.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.059 -179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -89.52 156.9 18.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.912 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 2.6 p30 40.57 58.09 2.44 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.504 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 618' ' ' THR . . . . . 0.505 ' H ' ' HG1' ' A' ' 644' ' ' THR . 3.6 m -134.29 148.68 50.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.077 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 78.9 p -87.06 130.21 34.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.746 179.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . 0.436 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 69.5 m-85 -134.63 135.21 41.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.959 0.409 . . . . 0.0 111.645 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 43.3 p -114.62 128.13 56.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.857 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.471 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 76.2 m-85 -120.08 168.94 10.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.458 0.647 . . . . 0.0 112.274 -178.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -167.42 152.67 7.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.314 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.442 HG11 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -118.97 155.86 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 112.266 -179.266 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.73 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 5.7 mmtp -140.77 142.68 34.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.757 -179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.52 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -101.33 128.2 47.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.489 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.444 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.52 140.29 50.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 179.65 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.61 167.99 9.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.75 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -66.36 -31.32 72.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.89 -179.265 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.2 10.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.569 -179.38 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 76.81 69.82 1.35 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.508 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.452 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 71.6 m-80 -148.2 124.04 10.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.685 0.278 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 25.7 m -112.59 139.44 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.044 0.45 . . . . 0.0 111.693 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 2.0 p -83.8 -164.93 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.248 179.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.535 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.94 161.33 23.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.73 0.3 . . . . 0.0 110.814 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.625 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -74.1 144.23 45.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.865 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.617 ' HG ' ' HB2' ' A' ' 563' ' ' PRO . 0.2 OUTLIER -72.15 -163.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.19 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.27 142.09 34.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.844 179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' A' ' 622' ' ' PHE . . . -79.65 116.22 19.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.065 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 621' ' ' THR . 11.6 p -101.03 131.82 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.129 -179.942 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 45.8 t -106.28 113.78 27.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.1 147.75 26.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.432 -179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -111.46 116.07 30.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.856 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.505 ' HG1' ' H ' ' A' ' 618' ' ' THR . 5.4 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.183 179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.603 0.239 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 12.3 mmt 67.14 -75.2 0.06 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.2 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -48.24 134.49 12.38 Favored Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.359 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -83.34 -158.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.731 2.288 . . . . 0.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 3.4 m -115.91 133.94 55.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.067 179.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 635' ' ' ALA . . . -64.54 127.33 92.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.247 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.434 ' HD3' ' HB1' ' A' ' 626' ' ' ALA . 73.3 Cg_exo -49.36 163.63 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.737 2.292 . . . . 0.0 112.003 179.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.2 t -155.07 158.43 39.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.366 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.2 m120 58.36 49.63 10.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.287 179.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.826 HD13 ' HG ' ' A' ' 578' ' ' LEU . 6.1 tp -71.16 158.49 36.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.306 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.626 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 174.51 13.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 0.0 111.475 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 568' ' ' SER . . . . . 0.545 ' HG ' ' HG2' ' A' ' 571' ' ' GLN . 0.2 OUTLIER -129.9 142.8 50.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.619 179.589 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.13 -78.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.277 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.67 96.53 10.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.186 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.545 ' HG2' ' HG ' ' A' ' 568' ' ' SER . 0.0 OUTLIER -115.03 97.6 6.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.92 179.873 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 61.1 p -92.63 -163.61 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 46.2 p -90.52 24.97 2.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.353 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 614' ' ' LEU . 24.9 p -163.83 -49.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.017 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.06 160.14 14.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.448 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.5 tt -151.18 137.08 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.926 0.394 . . . . 0.0 111.176 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -106.17 131.36 53.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.567 179.63 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.826 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -120.81 128.24 52.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.532 -179.208 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.6 t -123.73 128.34 49.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.405 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.62 ' HB3' HD11 ' A' ' 566' ' ' LEU . 44.6 p90 -140.64 170.21 16.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.959 0.409 . . . . 0.0 111.456 -179.355 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.3 m -79.6 123.02 27.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.143 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.58 162.63 8.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.22 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 7.4 m -71.46 158.2 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 17.45 3.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -138.5 44.22 2.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.799 179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -60.79 -12.87 12.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.162 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.7 -9.92 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.041 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.0 -29.82 0.6 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.569 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 7.4 t -65.31 145.48 13.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.644 0.259 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.4 t -117.64 -34.32 4.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.477 -179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.706 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -157.46 169.43 34.4 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.16 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -122.63 126.15 47.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.727 0.298 . . . . 0.0 110.763 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.606 ' HB3' HD13 ' A' ' 600' ' ' LEU . 1.3 m-20 -101.54 116.62 33.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.632 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.65 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.32 139.95 19.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.982 0.42 . . . . 0.0 111.106 -179.599 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.401 ' CE1' ' HG3' ' A' ' 625' ' ' LYS . 86.8 m-85 -102.21 146.58 27.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.278 -179.611 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.553 ' HB2' ' HB1' ' A' ' 601' ' ' ALA . 0.2 OUTLIER -101.67 84.59 2.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.179 179.105 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.13 -55.82 4.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.349 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.5 p -147.56 -56.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.774 0.321 . . . . 0.0 111.033 179.86 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.69 174.12 11.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.606 HD13 ' HB3' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -82.02 154.15 25.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.906 0.384 . . . . 0.0 110.986 -179.944 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 596' ' ' ASN . . . -141.08 -68.68 0.39 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.135 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -90.76 154.88 19.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.23 89.34 2.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.423 178.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.536 HG13 ' HA ' ' A' ' 609' ' ' ALA . 35.9 m -104.03 -176.03 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.613 -179.322 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.706 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.6 p -144.41 -11.56 0.62 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.111 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -96.91 -137.67 9.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.628 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.89 10.05 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.641 0.258 . . . . 0.0 111.396 -179.828 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -137.11 165.55 25.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.315 -179.902 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.536 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -141.8 150.91 42.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.158 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.6 m -134.43 118.33 17.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.303 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.448 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.5 mp -117.88 111.81 35.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.0 154.01 21.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.988 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.64 33.64 5.53 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.601 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 574' ' ' SER . 3.6 mt -107.58 155.8 19.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.783 0.325 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.68 159.97 15.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.95 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.02 179.58 5.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.401 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.18 28.39 17.68 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.077 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.15 150.47 44.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.468 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 75.3 m -100.64 121.08 41.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.29 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -114.46 129.39 56.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.993 0.425 . . . . 0.0 111.897 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.57 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.5 OUTLIER -108.75 121.91 46.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.787 178.907 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.457 ' O ' HG21 ' A' ' 623' ' ' THR . 97.1 m-85 -111.23 165.15 12.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.381 0.61 . . . . 0.0 112.395 -178.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.457 HG21 ' O ' ' A' ' 622' ' ' PHE . 7.0 p -150.44 149.99 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.709 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.65 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -117.01 152.78 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.955 0.407 . . . . 0.0 111.523 -179.769 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.7 mttt -140.62 139.79 34.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.204 -179.654 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.434 ' HB1' ' HD3' ' A' ' 563' ' ' PRO . . . -99.04 121.96 41.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.93 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.84 140.46 49.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.987 -179.813 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -105.2 175.01 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.893 179.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.95 15.29 4.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.293 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -113.26 6.45 17.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.976 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 80.11 9.9 86.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.475 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -102.14 125.38 48.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.43 HG21 ' N ' ' A' ' 634' ' ' SER . 7.7 p -126.89 137.94 56.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.093 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.43 ' N ' HG21 ' A' ' 633' ' ' VAL . 0.1 OUTLIER -77.1 -167.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.163 -179.759 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.504 ' O ' ' HB1' ' A' ' 562' ' ' ALA . . . -80.08 178.9 7.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.061 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.459 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.2 146.86 23.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.05 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.1 t -79.09 174.71 11.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -59.3 148.29 32.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.801 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -81.3 126.67 31.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.57 ' O ' ' HA ' ' A' ' 621' ' ' THR . 5.3 p -99.5 134.11 39.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.554 179.702 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.87 113.34 26.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 111.056 -179.398 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.414 ' H ' HG22 ' A' ' 642' ' ' VAL . 0.4 OUTLIER -122.95 131.34 73.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.901 179.826 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.39 113.99 25.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.2 -179.93 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.699 0.285 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -126.09 -48.35 1.61 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.003 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.425 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -63.54 151.95 86.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.014 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -68.5 -172.66 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.527 2.151 . . . . 0.0 112.311 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 18.2 p -99.93 135.45 41.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.405 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.427 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -64.12 132.24 95.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.128 179.769 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.44 ' HB2' ' HB2' ' A' ' 637' ' ' SER . 81.0 Cg_exo -45.47 153.74 0.63 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.616 2.21 . . . . 0.0 112.226 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.29 151.05 44.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.943 0.401 . . . . 0.0 111.62 -179.577 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 59.39 59.71 2.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.969 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.75 HD13 ' HG ' ' A' ' 578' ' ' LEU . 63.9 tp -74.83 159.95 31.28 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.891 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -161.34 173.35 15.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.021 0.438 . . . . 0.0 111.934 -179.657 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.71 129.11 36.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.307 179.381 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.8 p -106.36 -84.23 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 111.643 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.8 96.92 10.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.461 -179.426 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 644' ' ' THR . 1.8 tt0 -116.0 101.65 8.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.793 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.5 p -90.78 -157.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.072 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 40.5 p -95.24 25.21 4.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.465 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 78.8 p -167.36 -50.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.278 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.55 131.54 53.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.146 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.452 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 10.0 tt -121.99 143.31 35.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -107.15 117.01 32.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.579 179.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.75 ' HG ' HD13 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -108.63 134.99 50.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.149 -179.526 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -130.01 136.52 49.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.447 ' CZ2' HG13 ' A' ' 624' ' ' VAL . 36.1 p90 -148.59 169.78 19.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.902 0.382 . . . . 0.0 111.122 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 5.5 m -82.14 116.52 21.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.963 179.684 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . 0.42 ' HB1' ' HH ' ' A' ' 592' ' ' TYR . . . -61.25 155.25 21.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.048 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 m -59.46 120.61 9.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.79 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -15.96 61.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.9 -66.14 0.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.865 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 49.5 t30 57.71 -133.69 1.19 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.772 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.404 ' O ' HG13 ' A' ' 587' ' ' VAL . 3.8 p 45.1 23.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 111.655 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.44 -21.13 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.084 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.7 t -76.34 134.18 29.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.789 0.328 . . . . 0.0 110.713 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.89 -48.22 4.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.314 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.505 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.12 -179.35 26.77 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.87 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.42 ' HH ' ' HB1' ' A' ' 582' ' ' ALA . 68.7 m-85 -126.42 132.5 51.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 -179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.36 123.19 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.389 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.602 ' HB ' HG11 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.86 137.57 26.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.889 0.376 . . . . 0.0 111.228 -179.509 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.436 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 93.0 m-85 -99.47 145.39 27.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -114.92 89.74 3.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.368 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.56 -70.9 3.02 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.129 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.5 p -148.11 -16.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.865 0.364 . . . . 0.0 110.888 179.73 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -115.53 134.75 54.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 179.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.35 147.67 2.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.345 -179.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -115.33 -106.65 0.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.173 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.431 ' HG1' ' H ' ' A' ' 603' ' ' THR . 6.5 t -90.92 168.07 11.96 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.205 0.526 . . . . 0.0 111.854 -179.721 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.431 ' H ' ' HG1' ' A' ' 602' ' ' THR . 88.7 m -128.92 130.84 47.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.313 179.756 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.524 HG13 ' O ' ' A' ' 608' ' ' THR . 13.6 m -132.77 -177.7 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.501 -179.365 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.505 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 34.7 p -145.53 17.67 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.974 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -128.05 -121.85 2.44 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.761 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 607' ' ' THR . . . . . 0.432 HG21 ' O ' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -128.95 9.3 5.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.627 0.251 . . . . 0.0 111.41 -179.739 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.524 ' O ' HG13 ' A' ' 604' ' ' VAL . 1.1 p -139.72 140.08 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.36 -179.879 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.413 ' HA ' ' CG1' ' A' ' 604' ' ' VAL . . . -122.48 148.0 45.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.5 m -122.01 109.08 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.278 -179.896 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.452 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -102.34 126.71 56.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.096 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 164.97 13.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.864 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.85 47.78 5.18 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.473 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.5 mt -119.38 152.25 37.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 110.918 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.7 152.12 35.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.151 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -77.93 174.91 10.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.4 t0 56.86 25.55 10.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.14 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.72 161.57 32.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.054 179.827 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 47.5 t -121.94 137.28 54.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.82 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -135.62 172.54 12.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.943 0.401 . . . . 0.0 111.491 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.55 110.65 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.105 179.496 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.609 ' HD2' HG22 ' A' ' 642' ' ' VAL . 78.6 m-85 -99.73 165.65 11.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.227 0.537 . . . . 0.0 111.959 -178.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -159.62 153.07 22.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.882 179.628 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.602 HG11 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -118.57 150.12 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.924 0.392 . . . . 0.0 111.345 -179.763 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.436 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.3 mttt -136.0 150.16 49.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.083 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -106.26 129.27 54.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.223 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.464 ' HB3' HG11 ' A' ' 633' ' ' VAL . 1.9 ptmm? -127.78 142.62 51.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.28 169.72 8.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 179.848 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.62 48.7 1.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.74 3.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.084 179.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.84 61.81 1.74 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.458 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.8 m120 -145.48 106.98 4.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.646 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.464 HG11 ' HB3' ' A' ' 627' ' ' LYS . 29.4 m -118.82 137.98 51.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.378 -179.823 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.427 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -87.95 -167.0 1.74 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.718 179.808 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -73.0 170.95 13.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -83.14 138.78 33.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.78 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.46 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.51 179.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.234 -179.847 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.24 148.44 27.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.69 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.97 128.39 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.003 -179.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.3 m -109.73 115.08 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.268 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 19.6 m -79.81 100.95 8.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.287 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.609 HG22 ' HD2' ' A' ' 622' ' ' PHE . 63.6 t -99.86 108.79 23.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.37 -179.458 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 95.0 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.529 ' HA ' ' NE2' ' A' ' 571' ' ' GLN . 19.8 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.18 -179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.715 0.293 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 11.8 mtm 56.56 23.75 7.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.073 179.893 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -89.46 152.64 47.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.222 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.4 ' HB2' ' H ' ' A' ' 561' ' ' THR . 69.6 Cg_endo -73.45 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.562 2.175 . . . . 0.0 111.958 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.754 HG22 ' HB2' ' A' ' 585' ' ' ASP . 2.2 p -107.52 136.88 46.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.889 0.376 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 635' ' ' ALA . . . -67.18 129.9 93.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.305 -179.783 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.431 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 85.3 Cg_exo -47.28 152.48 2.21 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.729 2.286 . . . . 0.0 111.854 179.277 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.96 161.76 34.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.34 -179.652 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 61.1 34.05 19.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.938 179.639 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.857 HD13 HG11 ' A' ' 640' ' ' VAL . 1.6 tm? -69.15 117.51 10.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.117 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . . . . . . . . . . . -144.74 145.97 31.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.232 -179.821 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 2.1 p -84.83 150.74 24.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 179.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 6.2 p -124.29 -86.43 0.63 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.277 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.9 99.46 12.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.014 -179.926 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.52 ' HG3' HD11 ' A' ' 576' ' ' ILE . 1.6 tt0 -119.43 140.13 50.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.043 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 36.5 p -128.45 -167.85 1.83 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.895 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 6.1 p -87.38 32.98 0.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.189 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 23.2 p -169.46 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.315 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -110.69 135.97 50.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.248 -179.677 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.52 HD11 ' HG3' ' A' ' 571' ' ' GLN . 13.8 tt -127.71 139.32 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.78 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 20.7 m -110.27 122.2 47.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.135 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 608' ' ' THR . 13.1 mt -109.1 141.47 41.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.969 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.5 t -132.29 133.54 44.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.545 ' HB3' HD22 ' A' ' 566' ' ' LEU . 37.3 p90 -144.76 169.66 17.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.198 -179.599 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.7 m -84.69 128.25 34.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.199 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.24 25.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.047 179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 94.5 p -61.49 150.19 36.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.899 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 584' ' ' THR . . . . . 0.43 ' H ' ' HG1' ' A' ' 561' ' ' THR . 30.7 p -85.61 11.64 10.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.01 179.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.754 ' HB2' HG22 ' A' ' 561' ' ' THR . 0.4 OUTLIER -119.38 45.08 2.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.923 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.489 ' C ' ' H ' ' A' ' 588' ' ' GLY . 73.1 m-20 -65.11 -164.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.962 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 587' ' ' VAL . 11.2 t 66.41 -4.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.118 0.485 . . . . 0.0 110.906 -179.771 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -142.24 -16.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 585' ' ' ASP . 89.3 t -82.49 146.57 6.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.67 0.272 . . . . 0.0 110.781 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.536 HG21 ' H ' ' A' ' 591' ' ' GLY . 1.3 t -106.08 -54.41 2.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.638 -179.638 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.536 ' H ' HG21 ' A' ' 590' ' ' THR . . . -151.71 -172.21 20.28 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.137 -179.563 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.494 ' O ' HG22 ' A' ' 604' ' ' VAL . 89.4 m-85 -131.01 129.26 41.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.791 0.329 . . . . 0.0 110.586 -179.954 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.18 117.67 34.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.474 ' H ' HG11 ' A' ' 594' ' ' VAL . 0.2 OUTLIER -99.83 137.01 28.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.804 -179.892 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.588 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 33.9 m-85 -101.9 175.06 5.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.315 -179.444 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . 0.412 HD22 ' HD1' ' A' ' 620' ' ' TYR . 6.7 t-20 -140.48 89.3 2.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.737 179.666 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 85.32 -68.84 3.38 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.305 -179.736 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -150.3 -18.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.902 0.382 . . . . 0.0 110.638 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -114.6 135.25 54.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.742 179.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.588 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.1 tp -51.94 144.22 12.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.218 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -110.96 -98.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.101 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.443 ' CG2' HG12 ' A' ' 594' ' ' VAL . 2.9 t -90.83 160.2 15.87 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.108 0.48 . . . . 0.0 111.645 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 15.9 m -125.97 122.62 36.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.167 179.551 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 592' ' ' TYR . 30.1 m -127.83 -174.74 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.062 0.458 . . . . 0.0 111.998 -178.918 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.525 HG21 ' HA3' ' A' ' 591' ' ' GLY . 6.2 p -146.59 -2.29 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.889 179.843 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.49 -134.15 6.64 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.717 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.47 30.16 7.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.776 0.322 . . . . 0.0 111.242 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -157.77 141.17 15.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.215 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.403 ' HB2' HG22 ' A' ' 602' ' ' THR . . . -123.78 155.97 36.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.81 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 16.6 m -137.06 124.51 22.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.241 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.583 HG22 HD11 ' A' ' 614' ' ' LEU . 4.7 mp -113.68 128.34 70.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.96 171.08 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 61.02 64.81 3.74 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.675 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.583 HD11 HG22 ' A' ' 611' ' ' ILE . 0.4 OUTLIER -115.51 132.44 56.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.828 0.347 . . . . 0.0 110.868 -179.989 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . 0.422 ' H ' ' HH ' ' A' ' 620' ' ' TYR . . . -99.44 134.72 41.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.116 -179.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.12 168.23 16.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 16.2 t0 59.66 29.08 18.63 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.019 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.9 m -134.79 142.23 46.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.168 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 26.3 t -84.09 143.66 29.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.738 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . 0.422 ' HH ' ' H ' ' A' ' 615' ' ' ALA . 59.8 m-85 -136.87 142.35 42.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.151 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.4 p -132.57 114.2 13.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.289 179.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.534 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 81.3 m-85 -109.13 166.88 10.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.283 0.563 . . . . 0.0 111.905 -179.203 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -169.26 127.17 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.693 179.603 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.51 ' H ' ' HG ' ' A' ' 637' ' ' SER . 0.6 OUTLIER -99.36 149.55 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.491 . . . . 0.0 111.926 -179.056 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.517 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.1 mttt -128.24 166.36 18.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.332 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -116.06 123.78 48.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -121.38 154.44 36.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.829 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 171.74 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.57 47.69 1.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.361 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -153.92 -30.85 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.056 179.86 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 125.11 28.25 1.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.573 179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -112.7 120.29 41.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.77 0.319 . . . . 0.0 110.702 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.7 147.75 24.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.33 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.3 t -89.95 -154.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.524 179.68 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.445 ' O ' ' HB1' ' A' ' 562' ' ' ALA . . . -84.0 -179.5 7.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 179.725 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.517 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.15 140.3 29.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.371 . . . . 0.0 111.023 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.51 ' HG ' ' H ' ' A' ' 624' ' ' VAL . 4.9 p -68.45 -172.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.014 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.71 145.37 52.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.747 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.17 119.19 22.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.857 HG11 HD13 ' A' ' 566' ' ' LEU . 7.3 p -101.12 123.95 54.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.041 179.855 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.3 t -105.58 106.14 16.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.862 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -113.36 125.45 70.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.259 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.92 101.68 12.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 70.9 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.254 -179.963 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 17.7 m80 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.857 0.36 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 9.3 mmt -112.46 -62.82 1.52 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.082 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.462 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -56.47 148.08 46.18 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.406 -179.756 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.449 ' HB3' HG23 ' A' ' 589' ' ' VAL . 69.1 Cg_endo -74.09 -168.74 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.512 2.141 . . . . 0.0 111.817 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.748 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 70.2 m -109.81 113.27 25.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.173 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.33 64.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.737 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.519 ' HD3' ' HB3' ' A' ' 626' ' ' ALA . 86.4 Cg_exo -46.98 160.33 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.602 2.201 . . . . 0.0 112.381 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.8 t -155.28 157.81 37.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.555 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 11.3 t30 58.46 43.16 19.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.432 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.769 HD11 ' HG ' ' A' ' 578' ' ' LEU . 51.7 tp -61.45 160.58 10.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.303 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.472 ' O ' HD11 ' A' ' 578' ' ' LEU . . . -161.21 173.7 14.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 111.774 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.6 p -126.13 136.31 52.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.6 p -110.65 -86.88 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.534 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.16 98.5 11.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.819 0.342 . . . . 0.0 111.348 -179.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.423 ' HB3' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.12 104.09 10.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.844 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.8 p -103.83 -170.08 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 71.5 p -91.74 41.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.6 p -168.65 -42.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.259 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -135.28 137.47 42.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.136 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 610' ' ' THR . 13.7 tt -118.67 142.48 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.247 179.931 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.5 m -110.82 121.63 45.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.622 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.769 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -111.36 136.08 51.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.085 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.3 t -130.94 135.38 47.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.487 ' HB3' ' CD1' ' A' ' 566' ' ' LEU . 36.4 p90 -143.71 170.18 16.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.985 0.421 . . . . 0.0 111.428 -179.334 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.45 116.65 19.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.019 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . 0.43 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -60.74 170.06 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.266 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.748 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 2.6 p -88.33 138.91 31.02 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.996 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -13.94 62.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.337 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -110.03 59.23 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.846 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -78.24 5.2 10.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.2 p -67.57 -18.98 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.799 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -120.79 -24.98 2.43 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 179.901 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.637 HG22 ' HG ' ' A' ' 583' ' ' SER . 3.5 t -69.6 133.85 31.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.906 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 629' ' ' ALA . 2.9 t -120.28 0.52 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.439 -179.665 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.645 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.63 162.81 23.61 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.253 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.591 ' HH ' ' H ' ' A' ' 583' ' ' SER . 84.5 m-85 -122.05 145.56 48.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.811 0.338 . . . . 0.0 110.746 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.435 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 0.2 OUTLIER -123.03 124.54 43.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.723 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -101.18 132.6 46.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.035 0.445 . . . . 0.0 111.032 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.723 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 97.3 m-85 -99.74 149.31 23.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.954 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -131.35 100.4 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.757 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.9 69.52 1.24 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.332 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 68.1 p 48.41 29.51 2.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.925 0.393 . . . . 0.0 111.353 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -154.8 103.75 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.599 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.723 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -48.47 139.4 9.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.526 -179.451 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.38 -94.65 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.792 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.419 ' H ' HG23 ' A' ' 602' ' ' THR . 0.9 OUTLIER -91.07 163.13 14.41 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.111 0.481 . . . . 0.0 111.443 179.83 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 99.57 4.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.421 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.413 HG11 ' O ' ' A' ' 608' ' ' THR . 35.2 m -103.16 -167.88 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.648 -179.203 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.645 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.0 p -143.51 -24.03 0.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.014 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -83.33 -124.6 0.98 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.618 -179.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 607' ' ' THR . . . . . 0.43 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 0.5 OUTLIER -126.21 9.54 7.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 111.12 -179.875 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.552 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -131.19 157.63 42.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.246 -179.998 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.413 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.46 142.7 30.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.583 179.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.5 OUTLIER -125.24 131.2 53.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.557 -179.697 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.2 mp -115.83 130.39 70.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.131 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 3.2 p -99.37 -178.07 3.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.783 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 56.44 45.7 88.84 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.37 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.485 ' HA ' HD13 ' A' ' 614' ' ' LEU . 6.1 tp -97.66 148.06 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 111.133 -179.769 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.74 165.55 13.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 174.04 7.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.362 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 43.32 44.04 4.49 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.946 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.16 151.55 45.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.281 179.53 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -108.63 132.54 53.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.536 179.618 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -126.6 136.87 53.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.91 0.386 . . . . 0.0 111.411 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.37 116.26 31.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.087 179.094 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -114.0 163.6 14.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.255 0.55 . . . . 0.0 112.233 -178.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -155.72 147.18 22.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.645 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.95 152.65 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -179.625 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.584 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 4.9 mmtt -135.79 145.68 46.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.089 -179.531 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.519 ' HB3' ' HD3' ' A' ' 563' ' ' PRO . . . -109.98 115.68 30.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.462 ' HZ2' ' HG3' ' A' ' 627' ' ' LYS . 2.0 pttm -117.95 152.1 36.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.111 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -99.74 -159.3 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . 0.482 ' HA ' HG22 ' A' ' 590' ' ' THR . . . -51.56 -76.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.071 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.86 48.51 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.466 179.954 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -148.18 -66.06 0.01 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.42 -179.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.462 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 7.8 m120 -89.89 145.11 25.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.205 0.526 . . . . 0.0 111.811 -179.091 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.2 t -137.95 135.74 45.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 179.35 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 626' ' ' ALA . 0.6 OUTLIER -89.15 173.88 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.178 -179.513 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.439 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -82.39 171.65 13.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.212 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.465 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -81.14 143.36 32.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.1 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 637' ' ' SER . . . . . 0.484 ' HG ' ' H ' ' A' ' 638' ' ' ASN . 0.9 OUTLIER -78.4 -174.45 3.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.968 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.484 ' H ' ' HG ' ' A' ' 637' ' ' SER . 37.1 t30 -70.55 152.0 44.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.562 179.744 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.71 149.42 29.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.026 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.12 111.05 23.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.373 -179.888 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.0 t -89.29 112.57 23.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.68 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.28 140.52 31.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.09 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.34 100.79 10.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.845 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.102 179.977 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.609 0.242 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 57.52 -154.34 0.35 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.249 179.864 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -57.17 147.47 56.59 Favored Pre-proline 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.347 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . 0.497 ' HB2' ' H ' ' A' ' 561' ' ' THR . 86.9 Cg_endo -83.27 -140.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.695 2.263 . . . . 0.0 112.137 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 561' ' ' THR . . . . . 0.497 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -115.34 122.27 45.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.806 0.336 . . . . 0.0 110.853 179.661 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 635' ' ' ALA . . . -59.16 129.88 86.55 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.282 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.448 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 87.7 Cg_exo -45.8 125.39 8.01 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.66 2.24 . . . . 0.0 111.887 179.561 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 2.8 t -109.53 149.83 29.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.637 -179.431 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 m120 57.41 78.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.796 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.503 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 36.9 tp -90.35 159.27 16.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.303 179.118 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.527 ' O ' HD23 ' A' ' 578' ' ' LEU . . . -161.5 173.61 14.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.974 0.416 . . . . 0.0 111.649 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 77.6 p -124.65 143.26 50.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.326 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.31 -89.84 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.714 0.292 . . . . 0.0 111.77 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.71 103.15 11.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.602 -179.422 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.7 134.56 54.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.757 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.461 ' HB ' ' H ' ' A' ' 573' ' ' THR . 18.5 p -129.62 -161.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.793 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.5 HG23 ' HB1' ' A' ' 616' ' ' ALA . 16.7 p -96.77 27.49 3.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.48 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 88.5 p -168.65 -40.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.333 179.985 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -115.99 153.33 31.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.237 -179.651 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.44 HG21 ' HB ' ' A' ' 611' ' ' ILE . 19.4 tt -144.78 149.11 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.912 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 71.2 m -128.36 111.61 13.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.548 ' O ' ' HA ' ' A' ' 608' ' ' THR . 91.9 mt -100.45 141.46 33.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.102 -179.793 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 579' ' ' SER . . . . . 0.436 ' HA ' ' O ' ' A' ' 607' ' ' THR . 22.6 t -124.8 140.43 52.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.394 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.459 ' HB3' HD12 ' A' ' 566' ' ' LEU . 48.3 p90 -154.55 169.79 22.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.11 -179.568 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.4 m -84.55 122.38 28.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.862 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.17 160.49 3.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.147 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.2 m -56.72 158.91 4.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 32.2 p -96.97 12.79 31.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.573 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . 0.409 ' CG ' ' N ' ' A' ' 586' ' ' ASN . 5.8 p-10 -105.78 -57.98 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.143 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.409 ' N ' ' CG ' ' A' ' 585' ' ' ASP . 0.1 OUTLIER 48.98 24.13 0.82 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.783 0.325 . . . . 0.0 111.364 179.914 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.5 m -98.31 -2.86 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.052 0.453 . . . . 0.0 110.995 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -165.0 -8.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.844 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.431 HG21 ' OD1' ' A' ' 628' ' ' ASP . 16.4 t -65.27 128.75 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.866 0.365 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 590' ' ' THR . . . . . 0.47 ' H ' HG22 ' A' ' 590' ' ' THR . 0.1 OUTLIER -116.78 -30.5 5.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.277 -179.839 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.671 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -161.67 174.26 38.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.729 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -125.98 125.79 43.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.867 0.365 . . . . 0.0 110.905 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.45 ' OD1' HG23 ' A' ' 603' ' ' THR . 2.3 m-20 -100.03 119.11 37.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.6 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.83 135.41 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.006 0.432 . . . . 0.0 111.185 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.676 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.2 m-85 -99.88 129.71 45.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.982 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -109.93 89.16 2.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.586 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 68.45 72.34 0.83 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 27.0 p 46.66 30.04 1.07 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.952 0.406 . . . . 0.0 111.334 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.07 106.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.763 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.676 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 7.7 tt -47.1 138.81 6.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.449 -179.641 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -114.39 -92.11 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.0 179.816 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.6 t -90.69 168.01 12.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.256 0.551 . . . . 0.0 111.676 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 603' ' ' THR . . . . . 0.45 HG23 ' OD1' ' A' ' 593' ' ' ASP . 43.5 m -138.61 108.5 6.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.348 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . . . . . . . . . 13.3 m -105.86 -168.17 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.351 -179.28 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.671 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.4 p -143.06 -12.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.82 -135.49 8.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.549 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 607' ' ' THR . . . . . 0.436 ' O ' ' HA ' ' A' ' 579' ' ' SER . 70.2 p -111.3 5.13 19.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.775 0.321 . . . . 0.0 111.238 -179.896 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.548 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 2.3 p -115.38 164.14 14.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . . . . . . . . . . . -150.93 115.85 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.733 0.301 . . . . 0.0 111.11 -179.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.6 m -102.56 121.37 42.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.154 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -120.7 121.77 66.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 -179.979 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 80.2 p -101.01 174.6 5.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.774 179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.89 58.38 10.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.362 -179.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.1 OUTLIER -120.21 133.36 55.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.861 0.362 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -74.58 160.91 30.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.232 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.5 ' HB1' HG23 ' A' ' 573' ' ' THR . . . -90.11 147.01 23.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.002 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 52.97 52.95 12.84 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.1 m -134.34 142.4 47.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.175 -179.791 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.8 t -79.72 137.44 37.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.45 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -139.17 134.61 33.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.476 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -115.84 113.48 23.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.043 179.119 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . 0.471 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 63.1 m-85 -108.14 160.77 15.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.355 0.598 . . . . 0.0 112.372 -178.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.86 130.36 8.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.834 179.557 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.418 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -99.61 152.03 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.168 0.509 . . . . 0.0 111.724 -179.242 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.597 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 11.6 mttt -140.73 142.3 34.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.986 -179.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -102.19 122.92 45.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.127 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HD3' ' OD2' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -114.35 149.88 35.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 179.825 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . 0.431 ' OD1' HG21 ' A' ' 589' ' ' VAL . 95.5 m-20 -105.76 -179.17 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 -179.864 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.2 37.14 0.89 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.864 179.77 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -144.23 6.3 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.62 16.45 70.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.457 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.49 111.59 24.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.746 0.308 . . . . 0.0 110.789 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 633' ' ' VAL . 10.6 p -110.34 144.38 18.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.242 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.43 ' HG ' ' N ' ' A' ' 562' ' ' ALA . 0.1 OUTLIER -78.9 -162.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.012 -179.874 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.489 ' O ' ' HB3' ' A' ' 562' ' ' ALA . . . -81.84 178.39 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.103 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.489 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -90.33 147.45 23.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.294 -179.818 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 8.2 t -78.61 -177.11 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.755 179.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.09 142.71 58.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.535 179.682 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.93 120.01 23.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.955 -179.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.471 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.5 p -100.26 126.88 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.186 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.32 93.17 4.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.479 179.801 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 15.5 m -99.72 155.45 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.238 -179.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.26 118.15 33.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.768 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.081 179.945 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.1 m80 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.73 0.3 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -122.53 -61.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.696 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -65.48 149.82 96.71 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.819 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.9 175.85 2.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.44 2.093 . . . . 0.0 112.243 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 27.1 m -83.3 135.35 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.285 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.23 127.16 92.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.586 -179.774 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.419 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 60.4 Cg_exo -51.45 162.01 1.65 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.831 2.354 . . . . 0.0 111.838 179.261 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 8.1 t -159.56 169.41 23.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.279 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 57.82 33.79 23.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.348 179.653 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.703 HD11 ' HG ' ' A' ' 578' ' ' LEU . 53.9 tp -60.51 158.73 11.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.316 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.464 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -161.5 173.42 14.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.406 . . . . 0.0 111.553 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.9 p -129.43 127.48 41.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.372 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.57 -84.18 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.722 -179.53 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.71 97.0 9.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.44 -179.591 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.443 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.5 OUTLIER -118.63 106.41 12.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.718 179.703 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 39.3 p -95.65 -156.63 0.53 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.025 179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.2 p -99.34 24.15 8.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.453 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 87.4 p -163.95 -42.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.135 -179.972 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.502 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.7 OUTLIER -119.04 128.63 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.256 -179.661 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 610' ' ' THR . 11.4 tt -119.06 146.47 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 34.6 m -112.19 131.56 55.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.594 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.703 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -117.9 146.75 43.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.267 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 579' ' ' SER . . . . . 0.454 ' O ' HD12 ' A' ' 566' ' ' LEU . 12.5 t -140.91 140.2 34.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.471 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.419 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 40.2 p90 -155.55 169.77 23.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.256 -179.596 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.9 126.17 32.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.119 179.905 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.77 5.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.157 -179.915 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -72.62 157.49 37.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.945 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.7 -2.84 58.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -123.18 54.39 1.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . 0.517 HD21 ' HB ' ' A' ' 589' ' ' VAL . 17.6 t-20 -74.33 1.5 11.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.947 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 3.2 t -60.63 -14.58 9.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.318 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -135.32 -20.04 0.74 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.666 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.517 ' HB ' HD21 ' A' ' 586' ' ' ASN . 23.1 t -56.71 148.42 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.676 0.274 . . . . 0.0 110.984 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 19.6 p -130.59 -22.49 2.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.822 -179.565 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.64 179.09 40.17 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.041 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.412 ' CD2' ' HA ' ' A' ' 626' ' ' ALA . 85.9 m-85 -137.12 123.52 20.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.633 0.254 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -99.65 128.55 45.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.443 179.467 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.407 HG13 ' CB ' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -103.4 131.65 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.854 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.548 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 95.8 m-85 -99.43 150.44 22.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.651 -179.722 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -134.05 93.53 3.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.653 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.25 73.79 0.39 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.328 -179.676 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.6 p 47.97 35.93 5.62 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.875 0.369 . . . . 0.0 111.405 -179.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.98 104.59 1.53 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.122 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 2.0 tt -49.54 121.23 4.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.063 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . 0.466 ' HB2' ' H ' ' A' ' 602' ' ' THR . . . -88.2 -101.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.199 179.892 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.466 ' H ' ' HB2' ' A' ' 601' ' ' ALA . 4.5 t -90.67 169.95 10.56 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.18 0.514 . . . . 0.0 111.574 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.77 113.94 12.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.362 179.761 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.511 HG12 ' HA ' ' A' ' 609' ' ' ALA . 9.9 m -113.71 -175.17 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.621 -179.172 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.521 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -145.26 7.6 1.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.807 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.38 -120.68 3.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.649 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.49 -14.53 7.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.69 0.281 . . . . 0.0 111.338 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.503 ' O ' HG21 ' A' ' 604' ' ' VAL . 67.6 p -114.09 175.02 5.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.511 ' HA ' HG12 ' A' ' 604' ' ' VAL . . . -157.76 126.18 5.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.459 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.6 OUTLIER -111.47 133.48 53.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.907 0.384 . . . . 0.0 111.46 -179.66 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.4 mp -114.82 135.13 55.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -102.8 178.5 4.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 72.78 -84.75 0.56 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.427 -179.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 5.0 mt 49.58 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 120.9 0.381 . . . . 0.0 111.625 179.348 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . 0.504 ' N ' ' HH ' ' A' ' 620' ' ' TYR . . . -168.31 111.27 0.59 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.83 179.938 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . 0.446 ' HA ' ' HG1' ' A' ' 644' ' ' THR . . . -60.4 168.76 1.95 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.493 -179.74 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.73 28.5 17.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.284 179.821 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.44 148.21 40.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.335 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.49 135.0 33.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.452 179.547 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . 0.504 ' HH ' ' N ' ' A' ' 615' ' ' ALA . 57.6 m-85 -126.54 146.68 50.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.24 0.543 . . . . 0.0 111.981 -179.474 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.15 103.28 6.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -99.47 165.07 11.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.359 0.6 . . . . 0.0 112.031 -178.668 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.6 p -151.96 162.9 40.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 179.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.409 HG21 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -125.92 153.6 34.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.953 0.406 . . . . 0.0 111.548 -179.8 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.548 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.7 mmtt -140.36 124.63 17.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.047 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 592' ' ' TYR . . . -82.8 100.62 10.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.559 179.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.401 ' O ' HG12 ' A' ' 589' ' ' VAL . 0.6 OUTLIER -99.72 155.08 17.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.012 0.434 . . . . 0.0 111.163 -179.547 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.67 -156.7 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.211 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -49.56 -78.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.647 0.261 . . . . 0.0 111.263 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -161.06 48.35 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.517 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -169.62 9.25 0.05 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.755 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -152.43 131.41 12.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.262 0.531 . . . . 0.0 111.254 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.43 124.47 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.735 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.413 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 93.0 p -67.81 -164.55 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.935 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.44 169.72 10.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.994 179.781 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.4 137.7 32.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.888 179.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.7 p -73.56 -167.53 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.08 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -70.89 166.95 20.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.96 131.97 40.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.329 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.21 110.76 33.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.218 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.73 118.5 28.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.85 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.19 127.46 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -90.03 106.48 18.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 644' ' ' THR . . . . . 0.446 ' HG1' ' HA ' ' A' ' 616' ' ' ALA . 29.8 p . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.219 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.81 0.338 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 558' ' ' MET . . . . . 0.463 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER 66.17 0.93 1.8 Allowed 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.497 179.907 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 559' ' ' ALA . . . . . 0.559 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -82.4 149.57 61.79 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.14 179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -86.73 -172.31 0.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.212 2.608 . . . . 0.0 112.271 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.74 134.02 36.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.189 179.967 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 562' ' ' ALA . . . . . 0.439 ' HB2' ' N ' ' A' ' 635' ' ' ALA . . . -71.17 132.45 86.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 563' ' ' PRO . . . . . 0.499 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.9 Cg_exo -47.61 162.75 0.22 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.666 2.244 . . . . 0.0 112.214 179.64 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.7 t -156.11 161.86 40.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.37 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.2 m120 58.66 49.3 10.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.472 179.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.764 HD11 ' HG ' ' A' ' 578' ' ' LEU . 21.7 tp -75.19 158.27 33.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.376 179.479 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 567' ' ' ALA . . . . . 0.541 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.52 178.05 9.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.924 0.393 . . . . 0.0 111.448 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.12 129.51 48.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.22 179.442 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.7 p -103.34 -88.88 0.4 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.631 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 570' ' ' ALA . . . . . 0.638 ' HB3' ' HG1' ' A' ' 577' ' ' THR . . . -90.21 100.84 13.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.776 0.322 . . . . 0.0 111.33 -179.583 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 571' ' ' GLN . . . . . 0.659 ' HB2' HG13 ' A' ' 576' ' ' ILE . 4.0 tm0? -121.94 129.11 52.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.409 ' HG1' ' H ' ' A' ' 575' ' ' SER . 5.4 p -115.04 -161.52 0.78 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.766 179.69 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 47.5 p -91.55 11.89 22.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.745 0.307 . . . . 0.0 111.425 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 574' ' ' SER . . . . . 0.504 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 52.2 p -145.05 -43.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.409 ' H ' ' HG1' ' A' ' 572' ' ' THR . 0.1 OUTLIER -112.14 172.46 6.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.583 179.817 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.659 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.8 tt -160.27 139.59 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.379 . . . . 0.0 111.3 179.886 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 577' ' ' THR . . . . . 0.638 ' HG1' ' HB3' ' A' ' 570' ' ' ALA . 15.1 m -108.13 131.26 54.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.702 179.755 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.764 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -114.24 157.04 23.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.652 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 p -152.28 137.12 17.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.488 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 580' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 37.3 p90 -156.8 169.71 24.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.961 0.41 . . . . 0.0 111.371 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.9 m -81.18 135.69 35.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.136 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.02 172.45 2.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 67.8 p -83.44 9.62 10.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.38 24.68 5.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.231 179.943 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -142.75 45.79 1.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.779 179.879 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -62.6 -5.55 2.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.261 -179.836 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 5.6 p -76.02 4.19 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.14 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -150.41 -19.8 0.07 OUTLIER Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.881 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 589' ' ' VAL . . . . . 0.403 HG11 ' O ' ' A' ' 627' ' ' LYS . 6.0 t -78.93 136.7 23.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 41.4 p -106.84 -7.49 17.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.243 -179.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 591' ' ' GLY . . . . . 0.649 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 167.15 -179.86 40.56 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.67 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.01 128.87 39.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 593' ' ' ASP . . . . . 0.513 ' HB3' HD21 ' A' ' 600' ' ' LEU . 0.7 OUTLIER -103.25 116.76 33.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.809 179.934 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 594' ' ' VAL . . . . . 0.463 ' HB ' HG12 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -101.99 136.7 32.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 595' ' ' TYR . . . . . 0.44 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 47.7 m-85 -99.4 168.48 9.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.135 -179.657 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -133.05 84.75 2.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.151 179.377 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.56 -59.86 3.67 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.093 -179.386 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -161.84 -16.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 179.861 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -110.35 136.75 49.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 600' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.3 tm? -55.45 125.44 20.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.826 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -95.82 -104.87 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.372 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 602' ' ' THR . . . . . 0.564 HG21 HG13 ' A' ' 611' ' ' ILE . 9.0 t -90.54 165.39 13.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.271 0.558 . . . . 0.0 111.936 -179.397 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 57.8 m -129.92 128.36 42.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.003 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 604' ' ' VAL . . . . . 0.588 HG13 ' HA ' ' A' ' 609' ' ' ALA . 11.7 m -127.8 -177.93 2.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.839 0.352 . . . . 0.0 111.713 -179.364 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 605' ' ' THR . . . . . 0.649 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 72.1 p -137.87 2.04 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.878 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -117.09 -123.11 3.38 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.424 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 2.0 p -130.6 8.78 4.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.681 0.277 . . . . 0.0 111.165 179.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 608' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 40.6 p -130.19 126.18 36.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.266 -179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 609' ' ' ALA . . . . . 0.588 ' HA ' HG13 ' A' ' 604' ' ' VAL . . . -114.51 126.1 54.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.247 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 610' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.6 m -111.8 123.67 50.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 611' ' ' ILE . . . . . 0.564 HG13 HG21 ' A' ' 602' ' ' THR . 4.5 mp -106.56 138.68 30.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.086 -179.982 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.02 163.46 15.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.823 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 67.97 68.43 1.65 Allowed Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.436 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 614' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -123.05 152.5 40.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -97.53 155.07 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.996 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.52 161.89 15.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 55.54 38.91 30.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.008 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.13 141.45 36.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.114 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 89.9 p -87.7 131.26 34.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.721 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.366 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 621' ' ' THR . . . . . 0.522 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -106.42 118.56 36.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.29 179.249 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -111.34 165.11 12.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.21 0.529 . . . . 0.0 112.004 -179.151 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 623' ' ' THR . . . . . 0.484 HG22 ' HA ' ' A' ' 639' ' ' ALA . 0.8 OUTLIER -155.91 136.53 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.888 179.514 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 624' ' ' VAL . . . . . 0.463 HG12 ' HB ' ' A' ' 594' ' ' VAL . 0.0 OUTLIER -100.58 151.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 111.755 -179.297 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.7 mttt -139.81 157.65 45.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.704 -179.725 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . 0.505 ' H ' ' HG ' ' A' ' 634' ' ' SER . . . -109.22 145.2 36.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.201 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 627' ' ' LYS . . . . . 0.403 ' O ' HG11 ' A' ' 589' ' ' VAL . 0.0 OUTLIER -140.11 131.36 26.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.764 179.845 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.46 169.81 8.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.981 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.57 37.01 0.85 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.022 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -134.98 18.51 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.967 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 68.34 32.21 75.4 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.588 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 632' ' ' ASN . . . . . 0.559 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 47.5 m-20 -127.57 125.12 39.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.713 0.292 . . . . 0.0 110.915 -179.9 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -119.77 134.93 61.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.885 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 634' ' ' SER . . . . . 0.505 ' HG ' ' H ' ' A' ' 626' ' ' ALA . 60.2 p -71.56 -170.51 0.54 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.121 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 635' ' ' ALA . . . . . 0.439 ' N ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.7 173.72 8.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.596 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 636' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.64 134.43 34.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.971 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.3 t -73.06 -172.21 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.15 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 149.38 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.484 ' HA ' HG22 ' A' ' 623' ' ' THR . . . -84.24 128.0 34.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.197 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 640' ' ' VAL . . . . . 0.522 ' O ' ' HA ' ' A' ' 621' ' ' THR . 12.2 p -103.23 135.87 38.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -106.99 120.1 41.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.93 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.588 HG22 ' HG3' ' A' ' 571' ' ' GLN . 0.7 OUTLIER -122.92 127.27 74.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.95 179.957 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -96.68 103.52 15.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.184 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.671 0.272 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 589' ' ' VAL . 60.7 Cg_endo -72.49 -177.55 2.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.538 2.159 . . . . 0.0 112.436 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 69.5 p -91.98 155.78 17.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.105 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.735 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -83.08 127.03 70.86 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.447 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.3 Cg_exo -48.34 138.42 23.55 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.542 2.161 . . . . 0.0 111.683 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 52.5 p -128.28 162.47 26.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.524 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 59.38 54.38 4.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.598 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' ' 578' ' ' LEU . 65.5 tp -69.68 160.78 30.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.417 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.88 176.05 11.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.996 0.426 . . . . 0.0 111.581 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 70.8 p -136.52 122.81 20.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.461 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 7.0 p -99.42 -88.04 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.19 131.5 34.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.075 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.463 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -150.49 113.65 4.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.825 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.8 p -95.84 -153.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.99 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.2 p -97.62 22.41 9.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.9 p -166.15 -46.51 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.502 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.34 133.59 50.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.213 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 21.5 tt -124.33 153.17 30.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.043 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.7 m -122.95 121.68 36.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -105.72 149.47 26.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.452 -179.307 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 579' ' ' SER . . . . . 0.461 ' O ' HD12 ' A' ' 566' ' ' LEU . 0.3 OUTLIER -137.83 143.83 41.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.112 179.655 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.571 ' CE2' HG11 ' A' ' 624' ' ' VAL . 47.6 p90 -158.55 169.98 23.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.924 0.392 . . . . 0.0 111.483 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.93 128.88 33.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.26 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.99 155.09 32.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.05 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 16.4 m -65.07 142.34 58.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.91 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 6.8 m -64.44 -17.49 63.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.047 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -112.75 143.57 43.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.957 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -152.33 42.55 0.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -17.47 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.186 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -152.32 -4.0 0.16 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.551 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 560' ' ' PRO . 12.1 t -64.57 149.44 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.755 0.312 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 39.7 p -124.3 -51.5 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.515 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -153.86 -171.91 21.4 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.904 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -121.52 175.7 6.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.855 0.36 . . . . 0.0 110.975 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.49 ' HB3' HD21 ' A' ' 600' ' ' LEU . 3.6 m-20 -140.21 131.92 27.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.677 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.585 ' HB ' HG22 ' A' ' 602' ' ' THR . 43.1 t -99.9 126.23 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.205 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.429 ' HB2' ' OG1' ' A' ' 623' ' ' THR . 41.3 m-85 -99.97 129.47 46.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -106.55 84.77 2.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.542 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.91 -86.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.341 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -143.63 11.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.912 0.387 . . . . 0.0 111.054 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -137.0 151.1 48.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.09 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -60.32 136.02 57.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.417 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -113.06 -101.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.497 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.585 HG22 ' HB ' ' A' ' 594' ' ' VAL . 12.2 t -88.85 176.93 6.84 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.789 0.328 . . . . 0.0 111.425 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -140.58 140.03 35.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.931 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.805 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.9 m -140.39 177.48 4.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.496 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.515 HG22 ' HA3' ' A' ' 591' ' ' GLY . 1.4 p -144.57 3.26 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.018 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.63 -132.02 6.1 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 4.71 13.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.689 0.28 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.411 ' O ' HG11 ' A' ' 604' ' ' VAL . 36.8 p -129.89 -178.98 4.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.805 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -153.78 147.8 25.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.996 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.3 m -127.76 122.43 32.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.506 HD11 HG11 ' A' ' 594' ' ' VAL . 3.5 mt -121.68 118.11 54.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.976 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -102.84 175.24 5.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.866 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.58 70.76 0.99 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.498 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.513 HD12 ' O ' ' A' ' 574' ' ' SER . 8.5 mt -136.93 122.46 19.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.762 0.315 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -73.37 143.92 46.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.29 161.4 29.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.384 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.73 44.31 26.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.283 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.1 m -140.12 152.43 46.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.321 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.2 t -89.24 134.03 34.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -137.78 122.82 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.257 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 64.0 p -103.1 124.22 48.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -119.21 162.38 18.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.104 0.478 . . . . 0.0 111.732 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.448 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 0.8 OUTLIER -155.35 179.49 9.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.258 179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.571 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -138.54 147.26 25.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.004 0.43 . . . . 0.0 111.596 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.498 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 3.2 mmtp -141.02 120.21 12.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.38 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -80.13 138.45 36.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.634 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.455 ' HG2' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -124.77 161.93 25.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.881 0.372 . . . . 0.0 111.312 -179.725 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER -123.7 155.31 38.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.661 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.34 51.66 2.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.189 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.13 3.22 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.172 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 92.28 42.87 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.55 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.45 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . 18.5 m-80 -134.28 119.47 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.788 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.37 148.3 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 0.0 111.34 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 13.3 p -90.25 -165.94 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.735 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.29 176.18 6.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.714 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.498 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -89.96 146.76 24.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.044 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 6.6 p -81.15 -174.02 4.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.884 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.17 146.64 54.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.555 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 123.17 27.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.9 m -100.79 106.88 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.98 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.55 95.03 8.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.955 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.38 136.36 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.081 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.33 114.54 28.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.79 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.201 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.675 0.274 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.76 -159.86 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.668 2.245 . . . . 0.0 112.467 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 138.94 50.41 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.104 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.98 132.3 86.73 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.23 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.452 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.2 Cg_exo -45.75 155.91 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.77 2.313 . . . . 0.0 112.116 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 70.2 p -136.52 149.96 48.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.997 0.427 . . . . 0.0 111.742 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 59.36 65.01 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.004 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' A' ' 578' ' ' LEU . 1.1 tp -88.48 152.64 21.75 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.646 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -178.77 6.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.952 0.406 . . . . 0.0 111.341 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.36 127.38 39.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.309 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.82 -86.16 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.326 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.46 97.94 10.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.534 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -117.54 109.83 17.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 53.6 p -90.32 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 34.4 p -89.76 5.52 45.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.412 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 614' ' ' LEU . 20.2 p -140.35 -48.1 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -106.91 165.05 11.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.74 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 571' ' ' GLN . 20.3 tt -150.55 146.23 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.359 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 85.0 m -109.17 123.65 49.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.675 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -111.43 131.24 55.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.7 t -127.05 137.55 53.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.382 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.457 ' CE2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -154.52 169.74 23.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.143 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.1 m -88.01 129.43 35.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.994 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.74 165.09 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.9 166.57 13.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.033 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -1.4 53.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.836 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -117.95 64.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.418 ' O ' ' HB ' ' A' ' 587' ' ' VAL . 34.4 t30 -70.9 -153.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.611 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 586' ' ' ASN . 47.3 t 74.98 -37.74 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -108.98 -28.09 4.59 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.854 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.416 HG22 ' OD1' ' A' ' 628' ' ' ASP . 21.8 t -68.87 124.26 24.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.607 0.241 . . . . 0.0 110.585 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 18.4 p -123.38 1.15 8.99 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.755 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.18 168.72 40.67 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.193 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -131.08 162.21 30.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.787 0.327 . . . . 0.0 110.602 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.48 ' OD1' HG23 ' A' ' 603' ' ' THR . 48.2 m-20 -126.83 135.44 51.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.868 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.406 HG11 HD11 ' A' ' 611' ' ' ILE . 47.2 t -100.15 129.07 51.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.25 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.431 ' CE2' ' HG3' ' A' ' 625' ' ' LYS . 33.7 m-85 -107.29 129.63 54.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.723 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -123.91 94.23 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 60.11 72.05 0.68 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.507 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 8.2 p 46.12 34.48 2.11 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.907 0.384 . . . . 0.0 111.356 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.51 107.9 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.759 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 3.9 tt -52.36 122.83 9.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.078 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -91.81 -95.27 0.13 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.247 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 7.6 t -90.73 177.01 6.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.104 0.478 . . . . 0.0 111.79 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 603' ' ' THR . . . . . 0.48 HG23 ' OD1' ' A' ' 593' ' ' ASP . 7.5 m -140.61 134.17 30.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.545 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.778 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.4 m -136.67 -173.45 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.956 0.408 . . . . 0.0 111.589 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.755 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.6 p -131.81 -25.32 2.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.999 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -92.98 -151.19 27.64 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.484 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 17.7 p -100.41 12.94 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.843 0.354 . . . . 0.0 111.209 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.91 155.43 45.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.988 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.778 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.79 155.18 43.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.67 113.99 11.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.525 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -99.78 113.84 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.671 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 13.3 p -101.94 132.26 47.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.913 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.48 1.34 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.491 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 574' ' ' SER . 6.7 mt -137.0 114.35 10.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.768 0.318 . . . . 0.0 110.693 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -67.33 128.49 36.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -64.1 175.14 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.271 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 25.7 t70 57.09 30.39 18.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.07 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.4 m -140.18 144.74 36.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.45 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 619' ' ' SER . . . . . 0.41 ' HA ' ' HB3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -87.87 134.45 33.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.396 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -127.8 139.32 52.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 111.443 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.1 p -117.96 117.9 30.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.11 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 576' ' ' ILE . 68.2 m-85 -106.68 171.31 7.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.328 0.585 . . . . 0.0 112.164 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.91 173.67 8.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.102 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.552 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -139.68 150.14 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.981 0.419 . . . . 0.0 111.448 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 634' ' ' SER . 7.6 mttt -140.54 123.46 16.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.203 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.03 134.85 35.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.308 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -131.63 149.9 52.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.831 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.416 ' OD1' HG22 ' A' ' 589' ' ' VAL . 1.8 m-20 -111.73 -179.6 3.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.12 43.07 1.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.041 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.52 5.27 0.61 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.208 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 86.95 9.27 74.36 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.462 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.7 m-80 -93.43 116.95 29.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.9 p -125.06 135.38 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.56 -160.34 0.15 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.993 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.48 -177.08 4.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.045 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -89.93 136.77 32.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.552 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -72.15 -174.27 1.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.778 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.31 142.64 42.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -88.13 126.19 34.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.097 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.443 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 10.2 p -101.02 124.86 54.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 3.4 p -95.96 89.85 5.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.867 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.56 132.27 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 619' ' ' SER . 0.4 OUTLIER -112.61 133.66 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 111.126 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.088 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.676 0.274 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.425 ' HB2' ' H ' ' A' ' 561' ' ' THR . 83.7 Cg_endo -79.11 -139.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.721 2.281 . . . . 0.0 112.456 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.487 HG21 ' OG1' ' A' ' 584' ' ' THR . 0.2 OUTLIER -114.22 134.78 54.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.864 0.364 . . . . 0.0 111.048 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.678 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -78.46 130.11 72.47 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.455 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 52.0 Cg_exo -54.23 171.57 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.68 2.253 . . . . 0.0 112.042 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.8 t -163.6 164.25 24.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.28 34.62 24.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.3 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.804 HD11 ' HG ' ' A' ' 578' ' ' LEU . 35.8 tp -60.92 158.83 12.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.467 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.63 -177.54 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.263 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.3 t -144.89 126.97 15.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.066 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 17.8 p -99.78 -81.02 0.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.545 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -83.3 104.28 13.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.584 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.17 89.85 3.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.459 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 79.5 p -80.96 -158.8 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 63.1 p -94.57 22.86 5.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.61 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.444 ' O ' HD12 ' A' ' 614' ' ' LEU . 2.9 p -168.74 -44.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.706 0.288 . . . . 0.0 111.458 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.25 138.78 41.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.67 HD11 HG11 ' A' ' 642' ' ' VAL . 9.5 tt -130.26 148.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -116.29 109.8 17.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.804 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.899 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 579' ' ' SER . . . . . 0.441 ' O ' HD12 ' A' ' 566' ' ' LEU . 34.8 t -130.82 139.97 50.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.667 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.617 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -151.84 170.07 20.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 0.0 111.255 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.5 m -79.96 135.35 36.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.057 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.51 173.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 p -76.56 155.6 33.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.852 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 584' ' ' THR . . . . . 0.487 ' OG1' HG21 ' A' ' 561' ' ' THR . 71.3 p -91.45 18.21 7.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -126.46 -69.34 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 55.11 30.81 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.031 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.52 -12.09 9.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.021 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -156.63 -4.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.428 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.8 t -62.58 133.2 28.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.7 0.286 . . . . 0.0 111.179 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.448 HG23 ' HE3' ' A' ' 627' ' ' LYS . 1.3 t -112.47 -24.05 9.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.175 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.548 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -170.96 -177.85 41.13 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.665 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -126.66 133.66 50.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.833 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.27 117.43 34.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.502 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.38 132.66 44.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.902 0.382 . . . . 0.0 111.067 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 93.1 m-85 -99.43 170.38 8.66 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.036 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -140.23 85.6 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.319 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.18 -67.38 2.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.984 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -155.5 -9.04 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.824 0.345 . . . . 0.0 110.998 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -59.12 132.96 55.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.351 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -98.65 -105.67 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.87 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.9 t -90.77 173.18 8.15 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.962 0.411 . . . . 0.0 111.497 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 4.9 m -139.09 126.97 22.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.654 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.9 m -126.45 -169.1 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.368 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.548 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 7.2 p -137.36 2.01 2.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.208 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -126.3 -147.47 6.85 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.424 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 81.5 p -105.12 25.92 9.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.347 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.6 OUTLIER -146.5 127.31 14.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.096 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.846 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.93 140.36 51.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.157 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -116.85 115.05 24.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.9 mt -114.12 110.46 32.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.189 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 612' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 574' ' ' SER . 0.5 OUTLIER -112.5 158.52 19.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.769 179.787 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.48 29.59 9.3 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.617 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.444 HD12 ' O ' ' A' ' 574' ' ' SER . 6.0 mt -91.4 -173.91 3.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.764 0.316 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -123.18 120.31 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.06 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -57.9 159.78 5.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.94 37.39 28.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.165 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.4 m -140.13 146.54 38.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.255 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 28.1 t -89.47 139.34 30.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.638 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -140.15 125.35 18.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 111.254 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.44 123.87 46.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.519 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.413 ' HB2' HG23 ' A' ' 640' ' ' VAL . 67.6 m-85 -115.66 169.08 9.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.244 0.545 . . . . 0.0 111.829 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -159.28 159.62 34.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.59 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.759 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -121.12 148.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.132 0.491 . . . . 0.0 111.948 -179.508 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 634' ' ' SER . 8.3 mttt -140.35 157.89 44.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.688 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.68 141.24 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.413 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.448 ' HE3' HG23 ' A' ' 590' ' ' THR . 0.0 OUTLIER -131.16 153.71 49.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.784 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.51 174.78 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.942 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.65 56.3 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.85 -42.31 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.178 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.79 2.95 1.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.472 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -86.81 144.89 26.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 110.849 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 9.8 m -136.03 148.89 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.366 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.429 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.6 OUTLIER -87.18 -161.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.788 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.678 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.06 169.46 11.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 111.012 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.97 140.25 30.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.428 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -78.84 -173.5 3.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -60.28 155.07 18.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.902 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.83 154.08 27.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.096 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 622' ' ' PHE . 2.9 m -136.93 109.12 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.52 111.16 22.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.706 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.67 HG11 HD11 ' A' ' 576' ' ' ILE . 0.9 OUTLIER -112.55 152.41 14.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.989 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -113.98 106.5 14.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.021 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.652 0.263 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.559 ' HG2' ' HB2' ' A' ' 634' ' ' SER . 74.4 Cg_endo -73.52 -148.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.493 HG23 ' HB2' ' A' ' 583' ' ' SER . 0.1 OUTLIER -119.0 128.25 54.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.934 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.13 128.73 91.34 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.246 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 80.3 Cg_exo -45.16 145.67 3.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.698 2.266 . . . . 0.0 112.086 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 32.8 p -127.82 156.16 42.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.37 . . . . 0.0 111.685 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.08 60.75 3.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.71 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.585 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 13.0 tp -79.29 158.29 27.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.585 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.69 175.07 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 0.0 111.673 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 578' ' ' LEU . 13.7 p -127.03 128.94 47.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.5 p -99.57 -84.55 0.41 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.359 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.36 148.89 25.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.368 . . . . 0.0 111.167 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 136.78 8.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.732 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.421 ' HB ' ' H ' ' A' ' 573' ' ' THR . 31.9 p -134.22 -155.3 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.12 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.743 HG22 ' HB2' ' A' ' 616' ' ' ALA . 0.0 OUTLIER -95.28 20.73 8.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.301 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 12.9 p -167.06 -41.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.51 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -109.75 155.85 21.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.275 -179.45 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.453 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 15.0 tt -159.26 134.98 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 111.242 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 55.6 m -104.46 141.7 35.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.962 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 608' ' ' THR . 54.6 mt -123.7 146.06 48.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 51.9 p -133.39 127.16 32.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.733 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.503 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.8 p90 -137.21 169.6 17.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.172 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.7 m -87.12 138.09 31.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.129 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.76 166.5 2.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.222 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.493 ' HB2' HG23 ' A' ' 561' ' ' THR . 34.9 p -73.61 -3.67 29.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.928 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 59.34 16.29 4.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.077 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -148.27 68.18 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.592 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -82.0 25.24 0.58 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.196 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.01 -19.27 21.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.985 0.422 . . . . 0.0 110.661 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -149.69 -14.81 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.242 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 17.3 t -66.02 144.29 14.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.778 0.323 . . . . 0.0 111.065 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 75.4 p -123.74 -48.7 1.9 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.281 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.593 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -140.44 -174.68 14.04 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.787 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -133.81 154.84 50.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.683 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -121.73 137.71 54.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.952 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.426 HG11 HD11 ' A' ' 611' ' ' ILE . 56.1 t -104.19 128.42 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.755 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.54 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 40.7 m-85 -102.2 126.84 49.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.305 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 7.7 p-10 -99.02 84.32 3.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.225 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 82.84 -72.53 2.82 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.226 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 17.2 p -147.45 3.41 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.663 0.268 . . . . 0.0 111.265 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -121.75 173.96 7.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.453 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -90.3 119.15 30.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.638 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -92.83 -104.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.364 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 15.1 t -90.64 173.49 8.02 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 111.616 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 3.1 m -139.52 119.76 13.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 609' ' ' ALA . 12.7 m -122.41 -172.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.506 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.593 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 27.7 p -141.6 -10.04 0.93 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.098 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -102.07 -123.8 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.61 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 26.3 p -122.12 -13.12 8.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.713 0.292 . . . . 0.0 111.245 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.439 ' O ' HG11 ' A' ' 604' ' ' VAL . 27.3 p -105.58 172.74 6.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.081 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.74 155.14 36.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.187 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -129.95 117.17 19.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.209 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 575' ' ' SER . 5.7 mt -115.84 109.82 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.013 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.8 m -107.66 155.37 20.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.839 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 90.65 54.52 2.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.538 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.9 mt -118.82 144.16 46.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.88 0.372 . . . . 0.0 110.937 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -94.91 137.91 33.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.028 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 616' ' ' ALA . . . . . 0.743 ' HB2' HG22 ' A' ' 573' ' ' THR . . . -68.11 162.08 25.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.422 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 55.51 43.3 28.74 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.307 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 618' ' ' THR . . . . . 0.443 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 5.6 m -140.65 146.56 38.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.34 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.6 t -91.16 120.38 32.05 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.527 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 620' ' ' TYR . . . . . 0.443 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 74.8 m-85 -121.63 129.32 52.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.957 0.408 . . . . 0.0 111.524 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 64.0 p -104.33 141.02 37.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.92 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.655 ' H ' HG12 ' A' ' 640' ' ' VAL . 32.1 m-85 -129.31 169.05 15.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.274 0.559 . . . . 0.0 112.09 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.85 168.18 16.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.057 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.535 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -137.8 153.45 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.065 0.46 . . . . 0.0 111.56 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.54 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 1.4 mttp -140.41 149.95 43.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.92 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -105.18 136.92 43.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.505 ' HB3' HG22 ' A' ' 633' ' ' VAL . 0.3 OUTLIER -127.88 149.77 50.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.116 -179.661 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.464 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 1.8 m-20 -107.14 167.36 9.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.651 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.25 -8.92 58.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.149 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -92.56 -9.99 39.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 97.27 54.28 1.28 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.71 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -137.93 131.68 31.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.779 0.323 . . . . 0.0 110.975 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 627' ' ' LYS . 24.9 t -126.32 132.79 70.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.253 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.559 ' HB2' ' HG2' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -79.28 -157.48 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 179.656 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -89.34 177.23 6.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.872 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -86.26 143.51 27.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.46 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -73.24 -170.13 0.73 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.35 146.87 42.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.632 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.06 134.33 36.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.219 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.655 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -99.78 154.43 4.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.935 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.03 81.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.04 132.31 45.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.898 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -105.54 111.92 24.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.244 179.976 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.602 0.239 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.44 ' HG2' ' HB3' ' A' ' 634' ' ' SER . 40.2 Cg_endo -65.95 173.97 6.37 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.481 2.121 . . . . 0.0 112.236 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 1.4 p -84.97 127.43 34.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.049 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.72 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.86 127.28 91.45 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.042 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.418 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.3 Cg_exo -46.18 133.61 15.22 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.657 2.238 . . . . 0.0 112.039 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 27.7 p -117.15 153.4 32.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.658 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 58.95 77.35 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.773 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' ' 578' ' ' LEU . 24.6 tp -83.7 162.4 20.73 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.563 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -159.22 167.31 29.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.0 111.672 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 80.2 p -128.71 136.37 50.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.53 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -112.07 -88.13 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.504 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.96 108.69 19.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.451 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -119.91 98.9 6.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.832 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.5 p -86.63 -152.54 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.709 ' HB ' ' HB2' ' A' ' 616' ' ' ALA . 30.4 p -101.56 -10.77 19.81 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.687 0.255 . . . . 0.0 111.687 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 76.2 p -125.71 -33.86 2.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -123.44 159.43 29.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.945 0.403 . . . . 0.0 111.171 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.577 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.0 tt -142.07 151.42 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 5.5 m -118.82 127.62 53.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -121.39 137.87 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.332 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 37.5 t -128.6 146.76 50.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.282 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.455 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 48.1 p90 -157.79 170.07 23.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.924 0.392 . . . . 0.0 111.323 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.74 125.51 29.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.233 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.34 153.14 35.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.347 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -70.72 169.72 13.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.22 -19.19 20.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.959 0.409 . . . . 0.0 111.114 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.601 ' O ' HG23 ' A' ' 589' ' ' VAL . 3.0 t0 -89.03 37.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.767 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -58.46 -13.31 5.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.2 3.45 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.059 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -143.65 -24.73 0.16 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 585' ' ' ASP . 10.2 t -61.24 144.98 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 111.066 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 16.6 p -124.69 -9.96 7.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.286 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.624 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.03 172.45 36.54 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.513 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -124.65 134.12 53.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 111.16 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -100.94 135.84 41.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.451 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.556 HG11 HD11 ' A' ' 611' ' ' ILE . 97.8 t -101.75 135.13 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.6 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 57.0 m-85 -112.6 129.5 56.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.647 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -122.06 107.85 12.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 57.88 59.59 10.55 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.291 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.1 p 52.64 33.24 13.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.949 0.404 . . . . 0.0 111.327 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.81 111.6 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -47.81 153.67 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.623 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -134.93 -86.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.307 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.6 t -90.5 171.24 9.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.191 0.52 . . . . 0.0 111.85 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 46.5 m -140.36 123.53 16.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.494 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.772 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.0 m -128.27 -169.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.926 0.393 . . . . 0.0 111.549 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.624 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.1 p -142.0 -31.55 0.54 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.964 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -76.26 -125.22 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.435 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 16.7 p -122.84 -13.09 7.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.734 0.302 . . . . 0.0 111.159 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 50.0 p -108.67 155.71 20.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.021 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.772 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.35 145.28 38.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.071 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.4 m -127.01 119.76 27.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.2 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.577 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.6 mp -104.75 139.51 25.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.936 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.83 163.74 16.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 80.6 39.27 14.78 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.509 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -96.55 162.76 13.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 110.996 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -125.46 127.03 45.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.913 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 616' ' ' ALA . . . . . 0.709 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -59.31 160.12 6.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.447 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.83 43.66 30.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.207 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.7 m -140.42 146.46 38.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.396 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 6.0 t -86.92 137.54 32.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.472 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -140.12 131.14 26.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.015 0.436 . . . . 0.0 112.113 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -106.31 130.33 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.482 178.647 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -123.17 166.96 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.375 0.607 . . . . 0.0 112.548 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.09 160.48 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.822 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.453 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -128.25 150.95 34.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.098 0.475 . . . . 0.0 111.574 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.527 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.9 mmtt -140.18 149.73 43.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.872 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.63 150.42 29.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.747 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 141.81 39.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.752 0.311 . . . . 0.0 111.208 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -108.04 165.23 11.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.29 9.98 21.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -96.19 -0.04 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.075 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 90.22 27.77 19.68 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.489 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -128.1 159.68 34.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.721 0.296 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.53 145.97 26.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HG2' ' A' ' 560' ' ' PRO . 51.4 p -82.71 -174.81 5.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.72 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.28 178.69 6.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.995 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.527 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -88.0 142.95 27.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.453 ' HB3' HG23 ' A' ' 624' ' ' VAL . 2.4 p -77.2 -166.8 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.216 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.02 140.35 45.37 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.787 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.72 119.52 22.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.814 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 621' ' ' THR . 8.7 p -99.88 138.36 24.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.165 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.9 t -107.13 89.15 2.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.699 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.438 HG21 HD11 ' A' ' 576' ' ' ILE . 3.7 m -110.02 141.15 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.595 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -95.97 163.17 13.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.653 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 644' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 616' ' ' ALA . 4.9 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.224 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.63 0.253 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.455 ' HB2' ' H ' ' A' ' 561' ' ' THR . 90.4 Cg_endo -76.94 -149.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.593 2.196 . . . . 0.0 112.256 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.522 HG21 HG23 ' A' ' 584' ' ' THR . 0.2 OUTLIER -113.97 114.49 26.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.046 179.786 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.44 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -60.58 128.89 88.99 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.983 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.24 151.77 4.14 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.492 2.128 . . . . 0.0 111.899 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.55 156.09 45.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 59.09 45.53 14.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.725 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 580' ' ' TRP . 48.8 tp -66.71 156.7 34.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.439 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.11 168.87 21.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.414 ' HA ' HD23 ' A' ' 578' ' ' LEU . 59.9 p -124.04 143.93 50.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.156 179.217 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 14.9 p -125.05 -86.35 0.63 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.578 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.79 98.89 8.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 111.194 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -118.28 102.4 8.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.86 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 15.1 p -87.87 -152.02 0.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.842 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.3 p -100.83 -22.65 14.78 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.672 0.272 . . . . 0.0 111.627 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.0 p -122.22 -7.63 8.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.318 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.19 165.18 27.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.898 0.38 . . . . 0.0 111.038 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.424 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 18.6 tt -156.32 144.52 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.011 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.9 m -120.74 127.6 52.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 568' ' ' SER . 45.2 mt -119.75 136.16 54.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.8 t -126.29 139.06 53.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.316 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.55 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -150.62 169.69 20.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.852 0.358 . . . . 0.0 111.378 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 16.6 m -79.93 131.31 35.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.154 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.23 178.67 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.427 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.8 OUTLIER -84.63 169.87 13.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 584' ' ' THR . . . . . 0.522 HG23 HG21 ' A' ' 561' ' ' THR . 1.4 p -99.2 -15.54 18.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.722 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.454 ' O ' HG23 ' A' ' 589' ' ' VAL . 0.8 OUTLIER -118.04 61.28 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.017 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -73.83 1.53 10.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.005 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.75 -12.47 12.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.325 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -133.98 -18.92 0.93 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.594 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 585' ' ' ASP . 5.3 t -72.79 147.51 9.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.851 0.358 . . . . 0.0 111.105 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.5 p -117.91 -49.65 2.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.197 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.562 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -150.1 171.78 30.03 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.783 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -118.61 133.42 55.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.739 0.304 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.769 ' HB3' HD21 ' A' ' 600' ' ' LEU . 0.5 OUTLIER -111.35 120.5 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.943 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.37 138.36 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.811 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.493 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 95.7 m-85 -99.97 154.88 18.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.556 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.449 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 13.6 t30 -128.2 84.59 2.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.256 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 97.13 -71.06 0.75 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.426 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.26 4.36 0.14 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 111.378 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -128.2 172.09 11.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.769 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.0 OUTLIER -79.97 119.8 23.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.8 179.783 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.449 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -90.56 -105.47 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.011 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.4 t -90.5 162.27 15.12 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 111.238 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -127.69 128.83 46.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.635 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.0 m -134.45 -176.35 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.375 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.562 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 73.1 p -140.88 -15.42 0.9 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -91.46 -121.29 2.59 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.621 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.7 p -127.99 -4.41 5.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.831 0.348 . . . . 0.0 111.317 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.468 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -113.9 168.86 9.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.136 179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.635 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -154.27 119.4 5.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.915 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.5 m -107.33 120.21 41.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.409 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.424 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.3 mp -109.42 131.04 61.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.749 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 87.4 p -111.98 172.09 7.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 62.5 80.58 0.11 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.469 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.1 mt -137.87 179.58 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.856 0.36 . . . . 0.0 110.959 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -124.94 155.23 39.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.905 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 161.84 15.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.317 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 6.2 t70 55.68 43.4 28.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.059 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.37 139.05 35.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.333 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.2 t -86.05 131.24 34.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -129.34 137.39 50.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.282 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.13 119.44 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.379 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.409 ' HB2' HG23 ' A' ' 640' ' ' VAL . 71.7 m-85 -113.55 159.87 19.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 111.901 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.73 137.69 11.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.217 -0.902 . . . . 0.0 109.792 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.55 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -99.94 149.05 6.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.024 0.44 . . . . 0.0 111.569 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -136.79 152.94 50.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.04 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.45 137.63 50.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.236 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.44 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.437 ' OD1' HG22 ' A' ' 589' ' ' VAL . 4.2 m-20 -108.78 170.08 8.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.61 11.04 16.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.999 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -105.51 -13.52 15.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 98.88 41.34 3.11 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.547 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -135.93 130.4 33.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.5 t -124.7 131.09 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -77.09 175.21 9.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.929 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -65.26 168.05 7.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.265 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.51 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -79.53 140.15 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.438 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.2 t -67.66 -179.49 1.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.013 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -65.57 153.75 40.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.667 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.51 142.35 31.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.299 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.409 HG23 ' HB2' ' A' ' 622' ' ' PHE . 3.7 m -129.91 114.33 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.74 123.52 34.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.34 119.48 55.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.181 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -92.01 101.34 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.194 -0.907 . . . . 0.0 111.104 -179.872 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.551 0.215 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.17 -152.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.533 2.155 . . . . 0.0 112.445 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 583' ' ' SER . 5.7 m -111.53 131.31 55.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.012 0.434 . . . . 0.0 111.396 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.62 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.58 130.68 88.04 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.383 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.556 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -45.69 146.13 3.94 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.74 2.293 . . . . 0.0 111.819 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.3 p -119.95 137.13 54.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.992 0.425 . . . . 0.0 112.005 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 54.79 94.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.035 179.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.829 HD11 ' HG ' ' A' ' 578' ' ' LEU . 54.6 tp -89.8 160.36 16.55 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.524 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.75 178.74 9.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.422 . . . . 0.0 111.684 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.37 149.4 36.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.421 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 5.4 p -124.83 -84.82 0.64 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.602 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.48 112.5 20.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.433 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.57 ' HB2' HG13 ' A' ' 576' ' ' ILE . 5.8 tt0 -134.9 114.02 12.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.904 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 23.8 p -104.07 -165.78 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.82 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -91.17 29.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 11.3 p -162.33 -39.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.021 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.19 171.77 8.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.958 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.57 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.5 tt -159.48 151.19 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.419 . . . . 0.0 111.164 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.3 m -119.43 133.69 55.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.793 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.829 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -121.79 131.39 54.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.027 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.83 127.96 46.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.525 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.453 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -137.29 170.05 16.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.5 m -84.79 134.59 34.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.028 0.442 . . . . 0.0 111.344 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.55 168.63 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.009 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.746 ' HB3' ' HB ' ' A' ' 561' ' ' THR . 1.2 m -79.75 162.52 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.795 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.72 -7.15 58.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.793 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.508 ' O ' HG23 ' A' ' 589' ' ' VAL . 41.1 m-20 -125.16 64.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.823 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.06 0.92 16.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.71 -9.54 13.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.105 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -130.86 -21.22 1.12 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.405 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 585' ' ' ASP . 22.9 t -70.43 141.81 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.1 t -126.14 -11.43 6.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.111 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.602 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -178.03 -177.57 46.88 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.715 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -134.02 157.94 44.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.935 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -120.41 129.66 54.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.463 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.563 HG22 HG13 ' A' ' 624' ' ' VAL . 56.8 t -99.61 140.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.231 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 92.0 m-85 -123.64 147.93 46.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 621' ' ' THR . 25.1 t30 -137.95 88.91 2.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 76.29 59.26 3.39 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.093 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 43.4 p 50.46 44.46 26.94 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.891 0.377 . . . . 0.0 111.261 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.04 121.0 4.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.381 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 594' ' ' VAL . 1.0 OUTLIER -54.97 130.73 42.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.872 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -112.93 -98.65 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.349 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.7 t -90.61 171.6 9.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.117 0.484 . . . . 0.0 111.821 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 2.8 m -137.58 127.8 26.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.46 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.794 HG11 ' HA ' ' A' ' 609' ' ' ALA . 15.5 m -130.59 -178.22 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.906 0.384 . . . . 0.0 111.542 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.602 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 1.4 p -133.21 -24.93 1.81 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.168 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -85.64 -126.25 1.71 Allowed Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.467 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.44 7.93 6.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.827 0.346 . . . . 0.0 111.039 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -129.2 152.83 48.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.971 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.794 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -126.9 155.7 42.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.02 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 89.0 m -134.73 109.11 8.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.997 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.45 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -110.52 116.12 51.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.002 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.71 -174.44 2.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.862 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.27 47.65 77.99 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.635 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.2 mt -117.73 173.84 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.881 0.372 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -135.76 169.87 16.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -84.62 171.11 12.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.364 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 55.7 42.42 29.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.814 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.22 143.19 42.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.285 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 619' ' ' SER . . . . . 0.47 ' HA ' ' HG3' ' A' ' 643' ' ' LYS . 0.1 OUTLIER -98.61 132.21 44.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.218 179.349 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -126.62 125.9 42.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.437 . . . . 0.0 111.911 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 596' ' ' ASN . 1.8 p -110.22 107.71 17.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.643 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.494 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 39.1 m-85 -100.15 156.33 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.523 0.677 . . . . 0.0 112.729 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -159.22 122.13 3.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.306 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.563 HG13 HG22 ' A' ' 594' ' ' VAL . 0.0 OUTLIER -99.17 157.45 3.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 0.0 111.739 -179.0 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 635' ' ' ALA . 0.2 OUTLIER -139.98 155.06 47.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.341 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -104.51 132.14 51.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.793 0.33 . . . . 0.0 110.945 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 632' ' ' ASN . 4.3 pttm -120.81 159.83 24.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.96 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 630' ' ' ALA . 0.4 OUTLIER -112.97 177.85 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -76.64 -19.8 57.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.648 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.468 ' H ' ' CG ' ' A' ' 628' ' ' ASP . . . -100.62 31.64 3.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.52 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 56.42 81.38 0.07 OUTLIER Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.726 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.461 ' O ' ' HA ' ' A' ' 627' ' ' LYS . 1.9 t-20 -160.38 126.64 4.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 0.0 110.716 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 6.5 m -121.89 143.91 32.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.96 0.41 . . . . 0.0 111.711 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.462 ' O ' ' HE2' ' A' ' 625' ' ' LYS . 0.9 OUTLIER -82.78 -145.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.075 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.62 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.68 177.19 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 110.998 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.51 138.15 31.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.945 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.556 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 12.8 p -67.57 -169.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.855 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -63.36 177.68 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -106.2 121.31 43.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.448 HG21 ' HG ' ' A' ' 566' ' ' LEU . 2.9 t -112.03 115.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.684 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 11.1 t -102.47 102.45 12.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.966 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.64 114.77 48.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.928 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.47 ' HG3' ' HA ' ' A' ' 619' ' ' SER . 0.0 OUTLIER -96.86 122.07 39.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.123 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.159 179.768 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.633 0.254 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.74 -179.2 3.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.683 2.255 . . . . 0.0 112.459 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.05 136.66 34.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.408 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -64.24 129.4 94.04 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.5 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.469 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.82 140.08 10.14 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.69 2.26 . . . . 0.0 112.201 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.6 t -122.96 153.64 39.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.907 0.384 . . . . 0.0 111.727 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.94 62.55 1.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.787 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.832 HD11 ' HG ' ' A' ' 578' ' ' LEU . 55.3 tp -82.4 158.93 23.12 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.423 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.28 176.03 11.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.996 0.426 . . . . 0.0 111.786 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 20.6 p -130.24 122.62 28.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.233 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.8 p -99.83 -86.8 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.69 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.02 96.76 10.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.252 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.81 102.45 9.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 80.9 p -94.69 -155.43 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.18 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 644' ' ' THR . 4.9 p -90.16 3.36 53.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.473 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 3.4 p -152.49 -49.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.66 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.495 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -99.96 122.28 42.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.794 0.33 . . . . 0.0 111.408 -179.536 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.441 HD12 HG21 ' A' ' 642' ' ' VAL . 14.5 tt -115.49 150.22 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 18.6 m -120.27 119.33 32.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.756 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.832 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -105.85 136.41 45.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.938 -179.617 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.8 122.69 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.549 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.4 p90 -138.45 169.59 17.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.029 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 m -85.27 147.32 26.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.216 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.42 168.19 7.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.339 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -2.15 36.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.885 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 21.45 11.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.168 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -153.12 75.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -87.68 33.86 0.71 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.977 0.418 . . . . 0.0 110.829 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -85.56 -1.25 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.986 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -159.99 -25.84 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 13.6 t -59.03 146.81 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 111.258 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.7 p -120.05 -40.0 2.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.601 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -159.53 177.29 36.11 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.394 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -123.09 120.12 32.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.812 0.339 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.52 ' OD1' HG22 ' A' ' 603' ' ' THR . 4.7 m-20 -99.81 120.96 40.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.553 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.69 140.36 19.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.21 170.71 8.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.004 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.453 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 10.5 t-20 -140.26 86.35 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.608 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 83.95 -68.34 3.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.257 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.4 p -151.28 -12.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 140.79 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.922 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -55.24 149.11 13.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -114.63 -107.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.011 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 5.0 t -90.73 168.93 11.38 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.155 0.502 . . . . 0.0 111.667 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 603' ' ' THR . . . . . 0.52 HG22 ' OD1' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -132.37 121.26 23.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.543 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.849 HG11 ' HA ' ' A' ' 609' ' ' ALA . 31.5 m -125.64 -171.71 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.507 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.601 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.3 p -140.2 -12.41 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.145 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.11 -139.09 10.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.451 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 68.3 p -111.93 11.98 20.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 0.0 111.035 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -132.82 154.25 50.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.967 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.849 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.43 136.56 39.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.6 113.18 20.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.869 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.3 mt -107.26 144.09 16.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.55 -166.13 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 59.19 -108.56 1.67 Allowed Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.064 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.3 OUTLIER 56.89 104.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.958 179.109 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -70.01 111.69 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.634 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 616' ' ' ALA . . . . . 0.434 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -56.35 164.9 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.479 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 59.6 27.64 16.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.06 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.4 m -141.07 138.28 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.7 p -80.75 146.48 30.99 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.632 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -140.41 147.86 40.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.939 0.4 . . . . 0.0 111.56 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.536 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.49 120.29 39.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.06 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.468 ' CE1' HD13 ' A' ' 611' ' ' ILE . 96.9 m-85 -109.2 163.01 13.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.32 0.581 . . . . 0.0 112.213 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.09 142.92 19.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.604 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.578 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -107.94 142.5 20.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.076 0.465 . . . . 0.0 111.633 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -132.42 143.34 49.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.898 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.448 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -103.87 138.47 40.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.52 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.2 OUTLIER -128.55 137.0 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 0.0 OUTLIER -101.42 168.03 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.981 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.84 51.84 2.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.107 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -152.53 -25.43 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.21 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 116.58 28.66 2.47 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.302 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -121.9 124.63 44.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 0.0 110.682 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.52 HG12 ' HB3' ' A' ' 627' ' ' LYS . 9.4 m -120.83 135.82 59.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.375 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.448 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 10.2 p -69.85 -167.52 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.408 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.26 164.04 14.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -74.86 126.58 31.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.498 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.92 -177.12 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.624 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.11 157.67 9.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.536 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -90.35 131.17 36.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 3.1 m -114.04 109.71 29.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.049 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.6 119.77 27.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.441 HG21 HD12 ' A' ' 576' ' ' ILE . 12.1 m -123.88 160.28 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.222 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.68 112.18 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 644' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 573' ' ' THR . 62.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.168 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.578 0.228 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.56 -159.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.569 2.18 . . . . 0.0 112.276 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 583' ' ' SER . 4.5 p -112.59 123.63 50.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.11 132.22 87.37 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.699 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 78.5 Cg_exo -49.98 176.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.101 2.534 . . . . 0.0 112.413 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 5.1 t -155.66 148.92 24.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 111.605 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 56.77 68.01 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.653 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.884 HD11 ' HG ' ' A' ' 578' ' ' LEU . 49.4 tp -76.78 159.8 29.82 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.49 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.76 179.95 8.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.945 0.402 . . . . 0.0 111.567 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 82.3 p -142.67 130.21 21.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.463 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.7 p -100.6 -82.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.404 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 570' ' ' ALA . . . . . 0.492 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -86.12 97.08 10.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.25 97.19 7.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.6 p -84.14 -150.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.956 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 36.4 p -96.12 -45.24 6.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.73 0.3 . . . . 0.0 111.575 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 91.6 p -107.71 -3.68 18.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.625 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -139.69 163.7 31.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 111.135 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.473 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.5 tt -155.06 149.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.314 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.2 m -110.7 125.45 53.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.803 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.884 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.6 OUTLIER -108.94 149.26 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.245 -179.566 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.5 t -144.64 135.05 24.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.256 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.541 ' CD2' HG11 ' A' ' 624' ' ' VAL . 42.0 p90 -152.67 169.87 21.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.969 0.414 . . . . 0.0 111.36 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.6 110.61 16.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.781 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -51.18 151.32 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.304 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 561' ' ' THR . 0.0 OUTLIER -54.44 136.26 44.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.904 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 4.1 m -62.6 -23.63 67.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.858 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.04 46.46 1.01 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.485 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -65.04 -9.62 23.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.1 m -75.04 3.02 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.897 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -142.42 -2.9 1.06 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.427 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 627' ' ' LYS . 44.7 t -96.22 146.84 6.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.797 0.332 . . . . 0.0 110.967 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 8.1 t -111.2 -31.53 7.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.632 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -164.44 -179.9 38.84 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.878 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.41 135.52 44.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.435 ' OD1' HD11 ' A' ' 600' ' ' LEU . 0.3 OUTLIER -113.69 121.23 43.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.356 179.358 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.402 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -99.55 140.78 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.947 0.404 . . . . 0.0 111.206 -179.588 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -98.97 166.16 11.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.978 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -140.24 86.94 2.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 71.49 60.79 4.18 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.009 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.7 p 55.37 37.45 28.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.92 0.39 . . . . 0.0 111.487 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.65 112.25 2.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.435 HD11 ' OD1' ' A' ' 593' ' ' ASP . 1.1 tm? -45.88 131.17 9.58 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.353 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -113.08 -96.89 0.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.353 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.2 t -90.6 168.29 11.91 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.186 0.517 . . . . 0.0 111.985 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 18.2 m -132.5 141.6 48.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.575 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 3.5 m -140.35 -177.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.431 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.456 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 36.4 p -140.25 -13.27 1.04 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.932 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -98.1 -124.88 5.09 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.61 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.13 -14.67 8.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.3 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -101.24 176.64 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -158.78 123.57 4.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.138 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.6 m -105.42 117.27 33.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.235 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.7 mt -106.8 125.34 62.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.75 173.35 6.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.02 67.62 1.96 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.551 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 644' ' ' THR . 1.2 mp -130.59 153.5 48.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.966 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -121.45 141.45 50.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.158 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.93 174.31 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.68 28.72 14.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.2 m -139.16 141.42 38.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.99 137.38 32.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.587 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -132.62 133.19 43.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.391 . . . . 0.0 111.409 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -113.92 111.44 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.285 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -102.11 165.36 11.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.215 0.531 . . . . 0.0 111.913 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.495 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.6 OUTLIER -160.22 150.26 18.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.75 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.541 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -110.49 145.71 16.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.174 0.511 . . . . 0.0 111.777 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 1.1 mmtp -134.37 127.58 31.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.775 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.71 142.91 32.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.595 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.59 145.15 38.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -107.13 -177.51 3.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -86.23 -9.2 56.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.4 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -87.66 -6.0 58.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.129 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 91.09 23.34 30.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.4 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 2.4 m120 -108.27 148.09 30.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.686 0.279 . . . . 0.0 110.698 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.595 HG12 ' HB3' ' A' ' 627' ' ' LYS . 16.7 m -137.66 146.34 27.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.907 0.384 . . . . 0.0 111.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.85 -166.05 1.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.556 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.43 169.88 16.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.493 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.09 135.62 36.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.54 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -68.72 -175.27 0.66 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.426 -179.703 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 142.62 57.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.695 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.495 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -81.72 123.11 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 9.6 p -99.66 144.46 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.734 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.9 t -118.89 109.74 16.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.87 134.2 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.34 115.93 28.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.723 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 644' ' ' THR . . . . . 0.544 HG21 HD23 ' A' ' 614' ' ' LEU . 21.9 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.005 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.573 0.225 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.45 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.428 2.085 . . . . 0.0 112.25 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.439 HG21 ' H ' ' A' ' 584' ' ' THR . 0.1 OUTLIER -103.77 130.41 51.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.968 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.27 126.9 92.51 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.456 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.6 Cg_exo -47.5 148.15 5.69 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.556 2.171 . . . . 0.0 112.094 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 30.6 p -138.58 161.11 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 111.387 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.1 51.85 8.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.609 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.906 HD11 ' HG ' ' A' ' 578' ' ' LEU . 11.5 tp -73.89 158.61 34.15 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.583 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -177.64 6.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 111.531 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 86.8 p -138.97 125.72 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.368 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.1 p -99.8 -86.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.509 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.19 102.78 15.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.195 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.492 ' HB2' HG13 ' A' ' 576' ' ' ILE . 1.9 tm0? -121.25 116.86 25.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.957 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.5 p -98.56 -159.15 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.195 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.75 2.43 54.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.536 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.47 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.3 p -142.39 -47.99 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.803 0.335 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 1.0 OUTLIER -100.08 166.37 11.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.82 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.492 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.3 tt -154.91 142.58 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 7.0 m -109.21 113.55 26.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.78 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.906 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.0 OUTLIER -102.86 134.06 46.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.203 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 t -128.64 133.97 48.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.54 ' CE2' HG11 ' A' ' 624' ' ' VAL . 42.9 p90 -146.94 169.76 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.171 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -79.98 132.4 36.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.262 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.15 159.8 28.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.094 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.2 p -74.78 158.73 32.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.79 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 584' ' ' THR . . . . . 0.439 ' H ' HG21 ' A' ' 561' ' ' THR . 0.1 OUTLIER -69.86 -17.87 63.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.265 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -103.42 161.73 13.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -160.96 -10.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -6.34 8.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.746 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.33 -35.44 0.37 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.506 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 589' ' ' VAL . 4.7 t -59.07 148.45 6.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.5 -19.27 2.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.369 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.73 173.42 46.05 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.806 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -127.84 130.4 48.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.683 0.278 . . . . 0.0 110.836 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.84 126.26 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.614 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.443 HG21 HD11 ' A' ' 611' ' ' ILE . 0.2 OUTLIER -100.48 137.19 28.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.01 0.433 . . . . 0.0 111.625 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.753 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 98.0 m-85 -102.36 157.61 16.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.87 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -140.4 100.19 3.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.625 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 58.18 68.56 1.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.202 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.2 p 48.12 33.26 3.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.424 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.47 105.7 1.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.768 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.753 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.5 OUTLIER -47.92 137.7 9.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.386 -179.61 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.28 -98.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.9 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 4.0 t -90.64 168.39 11.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.185 0.517 . . . . 0.0 111.741 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 5.1 m -133.19 134.58 44.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.302 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.9 m -134.54 -179.75 3.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.496 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.554 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 40.5 p -132.29 -5.94 3.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.31 -131.04 6.9 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.471 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.09 4.69 10.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 111.063 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.469 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -128.63 140.1 51.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.9 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.829 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.79 157.77 27.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.164 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.75 102.46 5.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.962 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.462 HD13 ' CE1' ' A' ' 622' ' ' PHE . 4.2 mt -99.64 121.03 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.98 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.8 t -110.91 174.75 5.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.45 62.28 4.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.466 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 574' ' ' SER . 7.9 mt -130.74 143.14 50.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.866 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.24 142.92 35.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.043 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -76.99 159.22 30.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.285 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 11.5 t0 55.48 49.68 16.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.065 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.3 m -139.96 144.55 37.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 619' ' ' SER . . . . . 0.528 ' HA ' ' HG2' ' A' ' 643' ' ' LYS . 13.6 t -85.12 112.77 20.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.518 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.3 m-85 -115.83 134.54 54.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.954 0.406 . . . . 0.0 111.607 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.464 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.3 OUTLIER -111.31 125.34 53.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.235 179.136 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.462 ' CE1' HD13 ' A' ' 611' ' ' ILE . 73.2 m-85 -118.96 162.09 19.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.27 0.557 . . . . 0.0 111.935 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.03 138.56 10.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.861 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.54 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.78 151.6 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.065 0.46 . . . . 0.0 111.691 -179.576 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.435 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.6 mmtp -136.77 143.19 43.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.945 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -101.7 143.24 31.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.679 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.0 149.71 45.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.708 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.27 174.89 5.65 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.15 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.37 45.48 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.373 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -151.34 -17.47 0.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.957 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 105.44 36.5 2.84 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.343 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.516 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 87.5 m-20 -119.15 109.56 16.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.762 0.315 . . . . 0.0 110.827 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 627' ' ' LYS . 25.5 m -109.08 131.25 60.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.296 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -168.63 0.72 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.659 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -72.91 173.22 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.834 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.435 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -88.46 136.46 32.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.856 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.413 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.8 t -63.98 -174.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.273 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.53 143.71 48.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.686 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.544 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.68 127.59 32.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.281 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 640' ' ' VAL . 7.4 p -104.39 116.25 47.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.93 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.45 81.39 6.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.557 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 11.0 p -103.78 139.69 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.172 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.528 ' HG2' ' HA ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -111.54 155.53 23.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.654 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.246 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.538 0.209 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.91 -144.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.663 2.242 . . . . 0.0 112.168 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.706 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -117.0 121.23 40.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.5 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.42 130.12 94.06 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.142 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.481 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.2 Cg_exo -48.95 170.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.808 2.339 . . . . 0.0 112.341 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 4.6 t -158.49 159.13 35.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.252 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 55.88 59.68 3.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.492 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.748 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.1 tp -85.58 155.51 21.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.658 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.74 175.52 12.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.322 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 18.8 p -123.72 134.23 53.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.6 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.99 -86.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.275 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.66 98.58 11.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.422 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.493 ' HB2' HG13 ' A' ' 576' ' ' ILE . 1.1 tt0 -111.36 134.5 52.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 24.1 p -126.18 -162.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 35.5 p -94.0 24.25 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.244 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 53.2 p -165.79 -47.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.1 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -114.57 126.82 55.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.186 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.493 HG13 ' HB2' ' A' ' 571' ' ' GLN . 18.1 tt -120.44 144.78 28.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.061 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -104.63 133.03 50.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.748 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -121.78 143.86 49.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.02 0.438 . . . . 0.0 111.386 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -139.4 138.59 36.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.396 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.584 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.4 p90 -153.55 169.67 22.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 111.269 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.49 128.37 33.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.184 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.54 169.64 2.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.706 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 11.3 p -67.9 -13.89 62.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.17 11.86 4.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.279 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -109.9 -65.05 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.634 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 41.1 t30 55.85 21.22 4.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.235 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.31 -25.25 36.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -162.78 2.11 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.405 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 10.2 t -64.93 146.27 13.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.32 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 629' ' ' ALA . 20.7 p -115.7 -38.96 3.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.46 176.82 40.97 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.717 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -117.85 149.29 41.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.724 0.297 . . . . 0.0 110.724 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.56 116.28 20.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.876 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.98 137.52 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -99.44 168.75 9.79 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.087 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.572 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 44.3 t30 -135.15 88.07 2.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.541 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 93.84 -64.13 1.8 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.238 -179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -152.96 -39.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -90.27 171.15 9.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -75.06 133.12 41.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -99.8 -107.44 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.91 168.02 12.0 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.156 0.503 . . . . 0.0 111.554 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 16.6 m -131.49 133.5 45.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.542 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.2 m -137.87 -174.07 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.561 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.477 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.5 p -138.88 -15.87 1.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.045 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.68 -146.96 20.85 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.743 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.7 p -104.65 20.27 18.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 111.194 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.44 ' O ' HG11 ' A' ' 604' ' ' VAL . 38.6 p -136.49 160.88 37.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.964 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.32 148.3 42.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.0 106.25 7.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 575' ' ' SER . 2.7 mp -99.91 122.86 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.807 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 83.1 p -100.32 172.6 7.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.928 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 75.73 -87.71 0.85 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.373 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.447 ' HB3' ' H ' ' A' ' 615' ' ' ALA . 1.5 mt 47.62 -156.92 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.836 0.351 . . . . 0.0 111.505 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 615' ' ' ALA . . . . . 0.447 ' H ' ' HB3' ' A' ' 614' ' ' LEU . . . -164.58 134.74 3.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.791 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -81.96 166.11 20.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.496 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.69 35.92 24.67 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.172 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.33 168.53 19.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.215 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.84 120.72 40.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.192 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -122.9 151.0 42.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.098 0.475 . . . . 0.0 111.993 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -124.87 130.2 51.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.756 178.837 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.449 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 84.2 m-85 -114.63 155.75 25.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.419 0.628 . . . . 0.0 112.385 -178.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.7 p -149.14 148.55 29.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.502 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.584 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -116.54 153.87 18.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.983 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 0.5 OUTLIER -140.0 171.64 13.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.664 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.9 125.97 38.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.316 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -116.23 152.09 34.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.998 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -109.68 176.43 5.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.926 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 629' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 590' ' ' THR . . . -90.22 45.95 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.208 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.38 -28.44 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.045 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 123.1 6.71 7.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.343 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -96.94 119.9 36.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.6 p -115.9 147.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.91 -159.72 0.4 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.599 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.5 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.14 177.07 6.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.901 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -87.84 150.54 23.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.979 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.474 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -86.1 -171.87 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -64.93 159.77 22.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -100.81 123.76 45.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.22 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.7 p -99.89 123.34 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.03 103.51 15.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.671 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.52 146.32 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.222 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -104.19 108.15 19.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.732 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.138 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.537 0.208 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.426 ' HD3' ' HB2' ' A' ' 632' ' ' ASN . 70.7 Cg_endo -72.99 -153.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.616 2.211 . . . . 0.0 112.314 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 2.4 m -116.11 136.17 53.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -74.9 128.67 84.77 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.151 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.411 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 77.0 Cg_exo -47.45 154.4 1.64 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.681 2.254 . . . . 0.0 112.211 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.84 153.83 47.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.295 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 57.03 66.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.359 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.828 HD11 ' HG ' ' A' ' 578' ' ' LEU . 36.3 tp -86.93 159.8 18.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.276 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.479 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.44 172.93 15.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 0.0 111.732 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.39 135.03 49.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.176 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.68 -85.86 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.775 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 570' ' ' ALA . . . . . 0.474 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -85.08 102.88 13.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.863 0.364 . . . . 0.0 111.482 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.88 130.61 55.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 63.6 p -124.32 -156.81 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.297 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.2 p -94.69 22.58 6.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.408 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.502 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.2 p -164.71 -48.76 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.123 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.68 164.53 11.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.935 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.406 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 12.3 tt -158.29 145.6 8.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.329 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.474 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.0 m -107.32 136.11 47.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.497 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.828 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -127.63 125.5 40.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.872 0.367 . . . . 0.0 111.313 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 29.2 t -121.67 137.92 54.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.354 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.565 ' CD2' HG11 ' A' ' 624' ' ' VAL . 46.4 p90 -150.5 169.7 20.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.36 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 29.9 m -82.24 139.54 34.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.039 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.52 167.93 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.935 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 90.6 p -69.83 -3.98 18.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 9.9 p 52.52 24.36 3.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.007 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -124.0 -54.45 1.72 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 45.62 -154.74 0.04 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.825 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.4 t 54.32 19.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.151 0.501 . . . . 0.0 110.595 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -170.74 -28.79 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.801 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 591' ' ' GLY . 15.5 t -80.01 134.8 26.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.529 0.205 . . . . 0.0 110.629 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.494 HG21 ' HB2' ' A' ' 629' ' ' ALA . 31.4 p -124.96 23.96 7.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.75 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 152.16 167.86 15.71 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.247 -0.977 . . . . 0.0 113.182 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.27 127.27 37.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.85 0.357 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.656 ' HB3' HD11 ' A' ' 600' ' ' LEU . 2.7 m-20 -105.39 116.96 32.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.338 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.31 137.37 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.933 0.397 . . . . 0.0 111.268 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.422 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 87.1 m-85 -99.68 169.4 9.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.269 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -133.96 84.53 2.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 597' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 598' ' ' THR . . . 91.15 -52.66 3.19 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.224 -179.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.7 OUTLIER -158.53 -50.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.736 0.303 . . . . 0.0 111.225 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.85 173.48 12.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.958 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -79.33 149.29 31.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.418 ' N ' ' HG ' ' A' ' 600' ' ' LEU . . . -116.34 -104.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.748 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.417 ' CG2' ' HB1' ' A' ' 609' ' ' ALA . 9.9 t -90.92 162.65 14.67 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 111.151 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 22.8 m -127.33 117.13 21.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.899 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 609' ' ' ALA . 19.8 m -124.22 -173.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.507 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.75 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 25.1 p -140.75 -11.86 1.0 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.056 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.58 -140.84 11.56 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.632 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.93 27.99 9.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.786 0.326 . . . . 0.0 111.317 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.522 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.3 OUTLIER -149.93 153.24 36.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.949 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.735 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -137.49 144.09 42.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.028 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 34.5 m -122.35 110.89 16.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.281 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.406 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.6 mp -105.24 122.02 58.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.957 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 7.7 t -117.68 170.39 8.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.856 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 76.83 52.62 5.74 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.383 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 574' ' ' SER . 6.6 mt -122.27 161.8 22.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.87 0.367 . . . . 0.0 110.926 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.81 158.77 16.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -85.57 164.72 17.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.254 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 37.9 t0 55.91 42.33 28.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.222 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.5 m -140.54 139.24 35.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.407 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.68 136.43 35.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.237 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -135.73 118.66 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 111.739 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.97 107.4 18.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.906 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -99.52 160.48 14.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.363 0.602 . . . . 0.0 112.035 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 638' ' ' ASN . 4.5 p -150.89 152.88 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.835 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -113.83 152.87 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 111.482 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.0 mmtt -140.17 148.95 42.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.192 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -107.64 139.18 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.111 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.2 149.68 52.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.989 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -113.73 169.89 8.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.866 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 629' ' ' ALA . . . . . 0.494 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -81.75 7.81 11.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.151 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -104.15 -11.35 17.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.999 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 100.97 15.04 29.65 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.445 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.426 ' HB2' ' HD3' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -97.18 141.21 30.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.3 t -133.78 129.33 54.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.02 -171.59 2.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.41 176.0 10.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.18 134.5 34.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 5.0 t -66.0 -179.46 0.74 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.149 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 638' ' ' ASN . . . . . 0.412 ' O ' HG22 ' A' ' 623' ' ' THR . 0.8 OUTLIER -59.47 163.2 4.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.704 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -96.37 129.04 43.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.42 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.97 105.64 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 73.5 m -84.56 96.17 9.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 1.7 m -113.8 126.56 71.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.984 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -86.63 144.4 27.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.098 179.793 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.517 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 120.597 0.237 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -72.72 -165.55 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.506 2.137 . . . . 0.0 112.336 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.77 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 22.8 m -94.2 136.87 34.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.697 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -74.14 129.63 84.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.117 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.541 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -46.45 146.98 4.51 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.486 2.124 . . . . 0.0 112.053 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.1 154.21 51.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.968 0.413 . . . . 0.0 111.646 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.72 70.38 0.64 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.466 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.661 HD23 ' HB ' ' A' ' 640' ' ' VAL . 23.9 tp -83.63 159.59 21.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.391 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.529 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.95 169.77 21.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.834 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.478 ' HA ' HD23 ' A' ' 578' ' ' LEU . 0.0 OUTLIER -124.69 134.2 52.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.417 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.6 p -109.8 -89.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.533 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.52 99.95 12.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.83 0.347 . . . . 0.0 111.367 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.524 ' HB2' HG13 ' A' ' 576' ' ' ILE . 2.8 tm0? -122.6 120.85 34.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.8 p -110.18 -160.25 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.989 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 68.1 p -93.07 27.96 2.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.055 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.6 p -165.71 -58.6 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -102.73 129.57 49.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.93 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.524 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.0 tt -120.76 142.89 34.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.387 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 3.1 m -117.21 126.68 53.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.494 ' O ' ' HA ' ' A' ' 608' ' ' THR . 87.5 mt -119.85 146.44 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.525 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 144.72 51.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.995 179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CH2' HG11 ' A' ' 624' ' ' VAL . 47.8 p90 -154.61 170.18 22.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 111.282 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.52 131.22 34.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.815 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.06 176.66 0.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.405 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.77 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 23.7 p -74.55 147.18 41.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.968 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -10.73 59.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.178 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -91.42 -63.13 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 55.81 29.75 14.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.039 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.55 -24.88 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -163.4 6.53 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.9 121.56 13.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 111.112 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.441 HG21 ' HB2' ' A' ' 629' ' ' ALA . 1.3 t -119.48 -29.77 5.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.27 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.669 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -139.78 174.77 22.18 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.748 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.58 162.71 31.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.72 0.295 . . . . 0.0 110.691 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.09 119.11 20.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.858 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.674 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.69 146.27 9.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.866 0.365 . . . . 0.0 110.988 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 34.5 m-85 -120.17 164.66 15.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.822 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -140.32 87.6 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.627 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 67.63 71.35 0.95 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.153 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.7 p 47.49 39.6 9.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.928 0.394 . . . . 0.0 111.221 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -160.33 102.05 1.39 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.057 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -49.21 136.3 15.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.154 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -111.91 -98.4 0.42 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.306 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 594' ' ' VAL . 6.5 t -90.6 170.68 9.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.305 0.574 . . . . 0.0 111.983 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.8 m -136.54 137.26 40.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.864 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.632 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.3 m -132.03 -176.1 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.929 0.395 . . . . 0.0 111.955 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.669 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.7 p -130.61 -6.92 4.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.734 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.78 -147.38 9.71 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.536 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.2 p -100.18 1.99 42.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.694 0.283 . . . . 0.0 111.456 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.535 ' O ' HG21 ' A' ' 604' ' ' VAL . 11.6 p -114.32 165.58 12.56 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.632 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -151.03 134.13 15.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.2 m -121.84 122.77 40.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.307 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.478 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.8 mp -112.76 128.65 69.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.779 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.0 155.46 20.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.0 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 78.45 58.05 3.21 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.509 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.0 mt -115.01 154.5 28.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -103.43 144.77 30.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.021 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -87.39 164.2 16.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.65 35.27 22.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.87 156.93 47.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.336 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.3 t -95.05 137.53 33.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -139.41 134.73 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 111.269 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 37.4 p -114.21 125.65 54.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.078 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.404 ' CE2' HD13 ' A' ' 576' ' ' ILE . 92.8 m-85 -113.46 155.14 25.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.279 0.562 . . . . 0.0 111.957 -179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.51 122.58 5.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.827 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.674 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.1 OUTLIER -99.25 157.55 3.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.139 0.495 . . . . 0.0 112.029 -178.885 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 5.7 mttt -136.85 163.54 30.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.411 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.431 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -111.08 133.55 53.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 0.0 111.089 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -126.36 143.84 51.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.958 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -107.52 156.26 19.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.822 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 629' ' ' ALA . . . . . 0.441 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -82.51 62.69 6.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.405 ' HB3' ' OD1' ' A' ' 628' ' ' ASP . . . -157.89 -39.11 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.974 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 134.06 44.15 0.12 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.771 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 63.3 m-80 -141.91 147.95 37.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.728 0.299 . . . . 0.0 110.927 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -137.36 144.99 30.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.209 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 8.2 p -87.4 -164.69 1.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.752 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.697 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.88 177.49 6.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.548 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.558 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.75 141.55 31.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 111.228 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.541 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -72.29 -177.39 2.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.922 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.39 144.18 47.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.689 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.94 112.29 17.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.323 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.661 ' HB ' HD23 ' A' ' 566' ' ' LEU . 1.2 t -100.02 137.13 28.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.591 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.8 m -116.53 109.92 17.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.984 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.8 p -115.37 149.72 17.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.996 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -114.86 128.99 56.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.036 179.816 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.483 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.527 0.074 0 CA-C-O 120.684 0.278 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.448 ' HB3' HG22 ' A' ' 589' ' ' VAL . 85.2 Cg_endo -81.28 -157.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.629 2.219 . . . . 0.0 112.418 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.86 150.29 28.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.79 128.06 64.92 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.402 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.6 Cg_exo -48.1 153.05 3.0 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.703 2.269 . . . . 0.0 112.146 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.07 160.19 41.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.464 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 59.64 45.36 13.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.248 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.456 HD12 ' H ' ' A' ' 567' ' ' ALA . 63.9 tp -68.07 158.12 33.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.76 0.314 . . . . 0.0 110.68 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.456 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -162.07 -176.74 5.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.321 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.505 ' HA ' HD23 ' A' ' 578' ' ' LEU . 83.8 p -123.37 156.64 35.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.32 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.49 -89.4 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.727 0.299 . . . . 0.0 111.478 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.04 101.46 13.8 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.19 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.82 99.75 7.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.966 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 19.6 p -95.2 -155.18 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.812 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 14.4 p -96.99 19.59 12.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.51 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.546 ' O ' HD12 ' A' ' 614' ' ' LEU . 92.8 p -165.93 -46.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.136 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.78 137.88 39.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.434 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -133.1 141.25 45.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.43 131.84 55.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.011 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 76.2 mt -121.89 134.96 54.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.906 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 5.5 t -118.76 140.61 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.679 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.529 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.6 p90 -152.67 169.72 22.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.085 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.4 m -84.68 115.23 22.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -50.92 153.35 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.199 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.93 142.42 15.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.764 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 23.2 p -59.84 -15.35 20.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.228 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -112.46 153.91 26.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.034 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.482 ' C ' ' H ' ' A' ' 588' ' ' GLY . 2.3 p30 -153.06 -157.83 0.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.548 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.405 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 28.2 t 71.29 -22.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.365 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 588' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -124.8 -20.84 2.25 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.088 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.448 HG22 ' HB3' ' A' ' 560' ' ' PRO . 96.4 t -70.13 141.8 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 110.693 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -102.42 -67.07 0.89 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.8 -179.336 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.632 ' H ' HG23 ' A' ' 590' ' ' THR . . . -145.38 -176.36 19.27 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.005 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -121.79 127.35 50.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.887 0.375 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.44 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 5.5 m-20 -101.65 118.3 36.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.423 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.73 135.18 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.957 0.408 . . . . 0.0 110.909 -179.791 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.728 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.0 m-85 -102.59 151.1 22.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.847 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -127.74 93.14 3.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.178 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 50.7 72.93 0.42 Allowed Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.926 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.5 p 50.07 37.41 14.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.075 0.464 . . . . 0.0 110.931 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.9 94.66 1.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.728 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.728 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.3 tt -44.92 129.96 7.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.441 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.58 -103.05 0.19 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.129 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.4 ' O ' HG13 ' A' ' 594' ' ' VAL . 12.5 t -90.65 172.51 8.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.139 0.495 . . . . 0.0 111.683 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 603' ' ' THR . . . . . 0.428 HG23 ' OD1' ' A' ' 593' ' ' ASP . 63.1 m -138.32 105.29 5.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.268 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.8 m -105.98 -167.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.576 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.603 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.0 p -142.88 -0.55 1.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.031 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.88 -143.02 7.75 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.655 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.422 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 4.8 p -104.39 6.92 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.086 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -126.22 141.38 51.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.303 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -127.15 117.81 23.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.961 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.19 118.94 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.235 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.434 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -111.86 129.78 66.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.081 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 6.6 p -117.33 142.49 47.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 97.55 64.2 0.89 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.51 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.546 HD12 ' O ' ' A' ' 574' ' ' SER . 3.5 mt -130.86 158.47 40.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.846 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -110.64 138.73 46.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.154 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.83 172.37 8.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.177 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 28.4 t0 56.32 34.91 24.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.262 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.21 141.7 35.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.484 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.92 130.09 35.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.617 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -130.78 142.1 50.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.92 0.391 . . . . 0.0 111.501 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 1.3 m -120.4 133.35 55.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.342 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -121.88 156.79 32.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 0.0 112.068 -179.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 3.1 p -152.53 131.6 12.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.587 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.529 HG11 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -98.84 153.43 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.303 0.573 . . . . 0.0 111.804 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.637 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mttt -140.5 143.39 35.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.492 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -103.76 116.52 32.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 0.0 111.741 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.44 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -108.52 149.53 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.537 179.524 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.44 160.25 14.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.754 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.41 50.39 1.45 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.424 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -155.87 -35.19 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.012 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 132.21 39.74 0.22 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.396 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.483 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 1.5 t-20 -136.16 116.57 13.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.7 p -116.44 146.08 21.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.007 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.25 -167.0 1.7 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -77.14 -179.29 5.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.097 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.19 144.78 25.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.999 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.407 ' OG ' HG23 ' A' ' 624' ' ' VAL . 2.5 p -75.58 -174.89 2.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.917 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -64.9 150.1 48.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.785 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -83.92 128.19 34.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.204 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -111.78 105.39 18.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.991 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.2 91.44 8.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.973 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -99.61 171.61 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -143.5 128.8 18.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.839 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.139 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.57 -152.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.485 2.123 . . . . 0.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.601 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 17.8 m -113.67 127.75 56.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.119 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.521 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -61.42 131.72 92.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.445 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.51 159.61 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.883 2.389 . . . . 0.0 112.141 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.4 p -134.49 138.03 44.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.997 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.73 84.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.202 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.871 HD11 ' HG ' ' A' ' 578' ' ' LEU . 10.6 tp -90.63 159.39 16.44 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.615 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.73 164.46 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.037 0.446 . . . . 0.0 111.805 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.445 ' HA ' HD12 ' A' ' 578' ' ' LEU . 47.3 p -111.55 138.44 48.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.256 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.66 -89.88 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 570' ' ' ALA . . . . . 0.425 ' H ' ' HB ' ' A' ' 577' ' ' THR . . . -89.71 102.76 15.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 111.461 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.462 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.69 143.49 46.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.69 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.431 ' N ' ' HG2' ' A' ' 571' ' ' GLN . 24.6 p -129.92 -159.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.957 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.401 ' H ' ' HB ' ' A' ' 572' ' ' THR . 42.9 p -89.65 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.658 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.8 p -142.04 -50.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.791 0.329 . . . . 0.0 111.212 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -101.58 167.25 10.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.85 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.462 HG13 ' HB2' ' A' ' 571' ' ' GLN . 15.1 tt -155.92 147.42 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.425 ' HB ' ' H ' ' A' ' 570' ' ' ALA . 20.8 m -110.02 142.34 41.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.805 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.871 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.8 OUTLIER -132.89 133.4 43.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -127.55 139.95 52.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.507 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 45.0 p90 -154.39 169.68 23.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.3 m -81.5 138.15 35.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.335 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.39 171.84 8.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.223 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.601 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.9 OUTLIER -73.35 179.12 4.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.774 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -11.07 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.323 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -77.79 -63.98 1.26 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.051 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.8 m120 56.67 -161.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.774 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t 52.95 25.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.128 0.489 . . . . 0.0 110.655 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.97 -30.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.991 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.402 HG22 ' OD1' ' A' ' 628' ' ' ASP . 33.5 t -66.83 138.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.709 0.29 . . . . 0.0 110.508 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -107.55 -65.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.629 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -136.42 -164.79 10.33 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.31 -0.947 . . . . 0.0 113.251 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 592' ' ' TYR . . . . . 0.423 ' HB2' ' HZ2' ' A' ' 580' ' ' TRP . 95.3 m-85 -135.25 138.86 43.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.738 0.304 . . . . 0.0 111.009 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.14 119.22 38.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.414 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.2 137.78 25.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -104.13 147.76 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.726 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -109.05 84.15 1.87 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.323 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.5 -77.78 1.98 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -142.56 12.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.995 0.426 . . . . 0.0 111.138 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -132.69 174.51 10.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.382 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.95 133.91 34.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.77 0.319 . . . . 0.0 110.516 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.21 -108.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.692 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.4 t -91.79 171.83 8.88 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.303 0.573 . . . . 0.0 111.813 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.6 124.66 27.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.913 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.6 m -121.67 175.02 5.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.928 0.394 . . . . 0.0 112.027 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.504 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -132.56 -14.87 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.942 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -95.94 -108.98 2.42 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.597 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.72 -29.49 1.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.569 0.223 . . . . 0.0 111.489 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.537 ' O ' HG11 ' A' ' 604' ' ' VAL . 2.4 p -88.32 -177.04 5.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.188 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.671 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -160.68 133.04 6.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.977 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.2 m -119.01 110.35 17.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.072 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.414 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.8 mp -103.48 124.34 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.825 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 70.3 m -109.06 168.09 9.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 79.89 52.21 4.76 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.666 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 17.2 mt -118.13 165.75 13.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -127.44 131.93 50.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -68.53 176.32 2.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.285 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 59.43 22.25 10.72 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.44 151.32 44.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.364 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 67.6 m -92.37 146.1 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.325 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -139.6 128.88 23.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.91 0.385 . . . . 0.0 111.702 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.03 134.99 46.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.835 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -128.65 163.42 25.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.373 0.606 . . . . 0.0 112.159 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.1 p -147.54 164.8 32.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.83 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.471 HG23 ' CB ' ' A' ' 637' ' ' SER . 0.0 OUTLIER -135.01 142.46 40.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 111.548 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.7 mttt -131.25 162.87 29.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.737 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.9 132.46 55.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.179 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -123.65 154.6 39.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.402 ' OD1' HG22 ' A' ' 589' ' ' VAL . 0.6 OUTLIER -115.45 -179.91 3.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.894 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.95 -3.41 57.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -100.21 -0.09 39.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.025 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.27 35.25 15.12 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.652 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.468 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 9.8 m120 -116.32 132.92 56.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 0.0 110.919 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.8 p -120.2 147.19 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.094 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.41 -152.05 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.579 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.521 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.35 174.15 7.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.967 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.493 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.13 130.74 36.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.124 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.471 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -67.99 -178.71 1.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.76 150.48 36.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.749 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -90.07 125.08 35.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.507 ' HB ' HD23 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -102.39 150.63 6.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.774 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.83 125.97 54.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 6.4 p -127.4 134.99 64.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.934 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.1 111.84 24.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.934 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 120.654 0.264 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.555 ' HB3' HG22 ' A' ' 589' ' ' VAL . 57.2 Cg_endo -70.68 -152.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.508 2.138 . . . . 0.0 112.134 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -116.55 125.72 52.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.927 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.503 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.19 124.22 73.54 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.942 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.47 144.52 7.11 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.466 2.111 . . . . 0.0 112.105 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 51.2 p -132.66 155.44 48.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.401 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t30 58.76 64.46 1.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.447 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.0 tp -88.3 156.71 19.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.233 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.666 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.13 172.38 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.961 0.41 . . . . 0.0 111.589 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.464 ' HA ' HD12 ' A' ' 578' ' ' LEU . 40.1 p -118.18 128.96 55.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.354 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.9 p -99.87 -87.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.521 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.44 96.66 10.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 111.438 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.585 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.9 tt0 -112.26 136.32 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.771 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.7 p -130.66 -162.14 1.19 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.096 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.4 p -91.86 6.66 45.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.451 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.449 ' O ' HD12 ' A' ' 614' ' ' LEU . 77.0 p -135.95 -56.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.24 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.573 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 10.9 t -113.91 158.45 21.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.585 HD12 ' HG3' ' A' ' 571' ' ' GLN . 15.4 tt -142.0 136.33 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 1.7 m -99.72 129.55 45.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.646 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -119.08 133.15 55.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.097 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 84.8 p -125.7 146.95 49.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.291 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.424 ' HB3' HD12 ' A' ' 566' ' ' LEU . 49.1 p90 -159.2 170.33 22.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.936 0.398 . . . . 0.0 111.379 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.33 133.18 36.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -71.0 174.66 5.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.07 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 t -83.2 149.37 26.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.877 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 3.9 p -75.43 -7.7 54.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 589' ' ' VAL . 72.9 m-20 -125.25 67.83 1.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.738 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.77 3.91 13.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.96 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.64 -12.22 15.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.047 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.75 -32.14 0.57 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.543 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.555 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.1 t -61.13 150.39 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.733 0.302 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.11 -50.6 1.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.426 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -147.3 175.15 26.81 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.813 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -122.59 157.86 31.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.794 0.33 . . . . 0.0 110.978 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.68 120.88 16.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 623' ' ' THR . 0.2 OUTLIER -101.25 137.16 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.955 0.407 . . . . 0.0 110.731 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 59.2 m-85 -104.07 147.85 26.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.75 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -99.69 84.29 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.132 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 88.11 -62.26 3.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.125 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.4 -20.7 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.994 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -96.07 163.63 13.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.915 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -80.05 118.14 21.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.722 0.296 . . . . 0.0 110.465 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -90.09 -106.38 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.939 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.0 t -91.1 167.68 12.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.103 0.477 . . . . 0.0 111.358 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.31 130.02 38.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.214 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.823 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.2 m -131.79 -178.8 2.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.581 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 65.6 p -135.67 -17.09 1.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -94.83 -139.08 9.8 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.01 16.92 19.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.291 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -133.89 170.38 15.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.053 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.823 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -148.55 140.93 24.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.849 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -125.95 113.13 16.76 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.476 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.573 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -110.39 108.36 25.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.788 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.8 166.8 10.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.967 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 82.48 32.42 27.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.437 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 574' ' ' SER . 10.8 mt -92.83 166.95 12.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.857 0.36 . . . . 0.0 111.097 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -116.36 147.08 41.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.744 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -78.18 162.09 26.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.506 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 58.43 38.02 25.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.408 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.48 147.01 38.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.348 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.17 144.04 28.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.55 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -137.86 153.4 49.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 111.767 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.538 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -125.02 139.44 53.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.098 179.169 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.465 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 44.9 m-85 -132.75 152.07 51.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 112.327 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 45.4 p -146.57 128.51 15.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.659 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.516 HG22 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.53 147.47 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 1.8 mttt -132.43 169.8 16.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.499 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.08 130.88 48.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.867 0.365 . . . . 0.0 111.379 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -121.02 147.15 45.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.723 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.37 171.93 7.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.06 40.5 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.198 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -139.9 -41.44 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.076 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 142.1 -9.27 2.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.643 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -83.1 137.64 34.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 111.033 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -129.74 148.61 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.931 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.99 -164.11 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.503 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.08 178.01 6.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.024 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -85.69 149.37 25.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.414 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -82.61 -175.8 5.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.896 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -62.2 160.84 12.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.2 131.65 39.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 621' ' ' THR . 13.6 p -115.59 134.05 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 8.3 t -104.99 130.24 53.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -117.05 150.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.973 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.64 88.74 2.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.121 -179.986 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.49 0.186 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 628' ' ' ASP . 70.0 Cg_endo -73.41 -178.77 3.88 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.442 2.095 . . . . 0.0 112.319 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.61 154.71 36.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.69 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -91.86 129.97 40.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.334 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.47 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 77.3 Cg_exo -50.12 151.4 9.1 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.511 2.141 . . . . 0.0 111.749 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 45.5 p -139.19 156.89 46.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 111.693 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.54 54.19 5.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.779 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.831 HD11 ' HG ' ' A' ' 578' ' ' LEU . 16.5 tp -82.38 156.27 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.682 0.277 . . . . 0.0 110.302 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.543 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.04 179.66 7.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.998 0.428 . . . . 0.0 111.67 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 93.2 p -126.75 123.17 36.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.178 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.6 -87.27 0.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.846 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 570' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -79.78 97.9 6.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.7 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -113.33 119.48 37.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.528 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 11.6 p -113.77 -161.02 0.75 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.006 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 30.1 p -91.46 20.55 5.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -167.68 -46.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.736 0.303 . . . . 0.0 111.405 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -105.77 130.69 53.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.216 -179.682 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.1 tt -121.05 147.34 24.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.214 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 31.8 m -111.65 131.38 55.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.698 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.831 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.5 tp -121.66 130.44 53.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 11.1 t -126.76 136.59 52.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.68 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.61 ' HH2' HG21 ' A' ' 604' ' ' VAL . 40.9 p90 -150.98 170.41 19.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.837 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.8 m -79.39 127.35 31.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 582' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -61.7 133.31 55.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.1 m -72.04 151.92 42.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -177.51 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 49.6 m-20 54.63 53.4 10.69 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.92 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -65.76 -10.33 36.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.882 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.5 m -66.68 -10.22 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.258 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -125.28 -34.8 0.65 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.552 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 627' ' ' LYS . 2.8 t -65.7 130.27 30.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 111.048 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.01 -23.06 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.181 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -175.9 178.22 47.44 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.65 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -126.03 126.31 44.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.826 0.346 . . . . 0.0 111.014 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.75 118.7 37.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.54 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.81 130.62 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.5 m-85 -99.67 154.51 18.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.677 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -136.47 90.22 2.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.499 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 70.19 59.55 5.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.148 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.6 p 53.58 40.49 31.49 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.962 0.41 . . . . 0.0 111.393 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.84 111.44 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.907 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -48.6 124.28 8.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.336 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -100.75 -106.39 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.081 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.5 t -91.02 167.67 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.139 0.495 . . . . 0.0 111.525 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 6.6 m -131.78 129.02 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.376 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.688 HG11 ' HA ' ' A' ' 609' ' ' ALA . 14.9 m -130.32 -170.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.528 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.606 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.9 p -145.65 -26.69 0.46 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.97 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -79.03 -113.42 0.22 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.913 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 7.4 p -139.14 3.65 2.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.736 0.303 . . . . 0.0 111.241 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.573 ' O ' HG11 ' A' ' 604' ' ' VAL . 41.1 p -129.46 146.34 51.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.688 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -124.06 136.02 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.031 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.34 129.47 54.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.7 mp -125.45 119.53 55.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.065 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.99 131.44 55.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.007 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 115.99 60.1 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.625 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.5 mt -129.61 173.89 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.724 0.297 . . . . 0.0 110.698 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -132.3 145.01 50.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.74 173.31 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.172 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 55.34 38.17 29.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.64 161.43 36.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.399 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 m -119.99 127.46 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.591 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -123.89 149.49 45.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.997 0.427 . . . . 0.0 111.215 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 44.5 p -124.3 106.13 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.395 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.415 ' CE1' HD13 ' A' ' 611' ' ' ILE . 94.5 m-85 -100.0 157.75 16.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.212 0.53 . . . . 0.0 111.749 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.5 p -152.38 134.66 15.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.731 179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.724 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.37 141.1 17.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.277 0.561 . . . . 0.0 111.975 -179.158 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.596 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -130.03 152.21 49.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.551 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.604 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -110.15 144.26 39.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.466 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -122.12 176.71 5.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.543 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.647 ' HB3' ' HD3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -138.45 172.15 13.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.84 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.82 42.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.368 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -150.16 -6.69 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.165 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 93.13 35.52 6.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.444 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -119.17 138.91 52.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 35.5 m -114.65 151.6 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.604 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 0.7 OUTLIER -90.33 -157.78 0.5 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.394 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.69 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.76 156.96 18.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.791 0.329 . . . . 0.0 110.652 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.596 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.05 116.01 19.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.821 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.413 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -56.84 173.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.162 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -58.03 147.49 29.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.45 139.92 36.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.076 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.6 m -116.51 103.57 15.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.968 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 14.5 t -83.6 106.32 15.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.862 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.432 HG11 ' CD1' ' A' ' 576' ' ' ILE . 10.9 p -109.07 145.12 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.157 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 644' ' ' THR . 0.2 OUTLIER -120.29 111.49 17.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.722 179.73 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 644' ' ' THR . . . . . 0.458 ' O ' ' HE2' ' A' ' 643' ' ' LYS . 69.6 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.259 -0.876 . . . . 0.0 111.18 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.469 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.569 0.223 . . . . 0.0 111.018 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.81 -163.97 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.54 2.16 . . . . 0.0 112.343 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 583' ' ' SER . 5.0 m -100.29 124.63 45.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.101 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.434 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -62.97 129.65 93.48 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.486 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 85.0 Cg_exo -45.78 151.89 1.18 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.911 2.407 . . . . 0.0 112.295 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.2 p -136.17 155.49 50.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.9 0.381 . . . . 0.0 111.534 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 59.5 t30 57.23 67.47 0.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.576 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.856 HD11 ' HG ' ' A' ' 578' ' ' LEU . 15.2 tp -86.69 159.31 19.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.0 179.221 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.561 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.89 167.37 26.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.985 0.421 . . . . 0.0 111.888 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 4.6 p -121.23 146.65 46.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.334 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.1 p -125.98 -86.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.446 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 570' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 576' ' ' ILE . . . -82.15 97.93 8.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.194 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.98 95.28 4.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -84.45 -154.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.185 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.49 -11.55 39.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.69 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.7 p -136.82 -40.18 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.64 162.45 13.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.176 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -156.46 149.32 10.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.862 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.424 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.4 m -119.04 140.06 50.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.75 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.856 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -124.06 149.65 45.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.86 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 9.7 t -142.74 131.27 22.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.211 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.502 ' HB3' HD12 ' A' ' 566' ' ' LEU . 43.5 p90 -149.56 169.65 20.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.204 -179.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 m -79.89 143.61 34.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.961 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.44 170.18 0.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.442 ' O ' ' HB ' ' A' ' 561' ' ' THR . 2.2 p -69.87 -5.4 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.53 16.45 5.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -152.49 72.11 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.675 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.503 ' HB2' ' H ' ' A' ' 587' ' ' VAL . 0.2 OUTLIER -70.24 -128.87 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.721 -179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.503 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 4.2 m 44.1 26.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.119 0.485 . . . . 0.0 111.723 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -176.87 -37.62 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.918 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.67 144.4 13.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.564 0.221 . . . . 0.0 110.559 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.3 t -132.43 -30.11 1.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.748 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.49 172.41 30.98 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.011 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -130.93 134.87 47.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.691 0.281 . . . . 0.0 110.647 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -99.99 128.45 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.796 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.404 ' HB ' HG22 ' A' ' 602' ' ' THR . 61.6 t -99.66 132.51 44.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.979 0.419 . . . . 0.0 111.308 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.447 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 52.2 m-85 -101.31 124.66 47.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.928 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.497 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 47.6 t30 -100.06 84.61 2.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.92 -80.8 0.79 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.277 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 4.5 p -147.18 16.98 1.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.783 0.325 . . . . 0.0 111.072 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -145.35 173.05 12.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.57 HD22 ' H ' ' A' ' 601' ' ' ALA . 1.4 tm? -71.07 149.93 46.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.825 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.57 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -132.92 -100.94 0.26 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.342 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 594' ' ' VAL . 14.0 t -90.13 172.65 8.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.916 0.388 . . . . 0.0 111.428 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 80.1 m -140.34 126.07 19.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.858 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 609' ' ' ALA . 7.0 m -126.36 -177.09 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.528 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.748 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 67.4 p -137.89 -11.34 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.27 -126.52 5.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.464 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 4.4 p -122.72 -4.39 8.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.749 0.309 . . . . 0.0 111.059 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.465 ' O ' HG11 ' A' ' 604' ' ' VAL . 17.2 p -111.23 173.59 6.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.024 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -155.45 127.74 7.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.075 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.9 m -114.14 112.91 23.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.157 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.9 mp -105.94 131.9 54.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.937 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 15.9 p -120.89 173.73 7.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.106 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 74.8 44.47 24.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.727 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.3 mt -117.7 132.52 56.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.818 0.342 . . . . 0.0 110.825 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.02 143.88 35.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.96 167.38 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.21 35.06 25.72 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.8 m -137.51 146.43 44.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.232 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.83 136.88 32.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -135.76 140.36 44.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 111.615 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.559 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 2.0 p -111.97 135.02 53.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.532 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.635 ' H ' HG12 ' A' ' 640' ' ' VAL . 54.5 m-85 -126.45 161.27 28.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.279 0.562 . . . . 0.0 112.396 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.529 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.26 159.11 31.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.768 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.415 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -124.14 152.61 29.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.047 0.451 . . . . 0.0 111.497 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.551 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 3.8 mttt -139.15 139.36 37.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.803 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.533 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -94.96 116.42 28.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.0 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -108.71 148.59 30.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.104 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -116.19 169.92 8.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.773 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.64 -13.84 59.62 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.159 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -83.8 5.62 24.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.046 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.03 2.86 90.68 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.404 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.6 m120 -95.81 123.47 39.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.761 0.315 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.5 p -120.91 136.79 56.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.533 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 1.9 p -69.03 -167.51 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.952 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.434 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.3 -178.46 5.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.751 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.551 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.16 146.0 28.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.6 p -82.64 -164.13 0.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.7 146.63 54.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.617 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.69 148.68 31.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.916 0.388 . . . . 0.0 111.163 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.635 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -114.7 158.46 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.767 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 44.7 t -143.94 105.52 4.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.769 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.87 140.01 48.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.098 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.09 102.02 9.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.672 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.139 -179.851 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 560' ' ' PRO . . . . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.529 0.204 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 559' ' ' ALA . 39.3 Cg_endo -65.48 -169.06 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.603 2.202 . . . . 0.0 112.396 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.95 118.12 28.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.126 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.599 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -60.17 127.29 85.84 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.406 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 88.4 Cg_exo -46.87 156.66 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.701 2.267 . . . . 0.0 112.034 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.52 159.32 40.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.449 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 60.0 49.94 7.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.287 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.841 HD11 ' HG ' ' A' ' 578' ' ' LEU . 56.9 tp -74.07 159.67 32.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.424 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.451 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -161.33 -176.81 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.435 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 35.3 p -133.89 130.59 38.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.332 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.5 p -104.09 -85.29 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.454 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.81 103.56 14.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.05 116.94 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.809 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -108.68 -161.43 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.081 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.54 16.98 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.452 ' O ' HD12 ' A' ' 614' ' ' LEU . 1.8 p -161.63 -43.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.186 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.7 167.11 10.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.633 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.5 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.3 tt -160.44 147.31 5.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.907 0.384 . . . . 0.0 111.27 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.4 m -116.55 134.41 54.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.642 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.841 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -118.76 133.94 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.082 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.32 132.98 48.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.431 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.621 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.8 p90 -148.29 169.74 19.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.175 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 7.2 m -81.32 115.57 20.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.979 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 582' ' ' ALA . . . . . 0.74 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -60.1 154.24 19.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.329 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 84.0 p -61.28 132.96 55.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.894 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -19.91 61.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.222 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -89.38 53.58 2.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.453 ' C ' ' H ' ' A' ' 588' ' ' GLY . 42.0 p-10 -72.54 -150.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 71.53 -17.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 588' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -132.66 -26.8 0.63 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.88 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.401 HG13 ' O ' ' A' ' 627' ' ' LYS . 83.4 t -66.87 145.25 13.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.725 0.297 . . . . 0.0 110.81 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.4 -67.09 0.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.48 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -143.61 -173.06 14.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.931 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -125.84 130.85 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 110.876 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -110.26 120.75 43.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.662 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.68 136.16 32.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.906 0.384 . . . . 0.0 110.764 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -99.35 174.97 6.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.157 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -140.63 84.43 1.95 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.357 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 597' ' ' GLY . . . . . 0.461 ' O ' HG23 ' A' ' 598' ' ' THR . . . 86.06 -66.22 3.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.233 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.461 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -163.11 31.76 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.859 179.727 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.65 137.06 11.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.068 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 601' ' ' ALA . 1.0 OUTLIER -56.66 136.22 54.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.202 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.459 ' N ' HD13 ' A' ' 600' ' ' LEU . . . -109.74 -104.3 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.969 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.7 t -90.44 163.09 14.79 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.079 0.466 . . . . 0.0 111.344 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.5 m -126.95 131.55 51.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.616 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.786 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -135.71 -179.92 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.417 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.2 p -136.87 -5.79 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.45 -124.16 5.32 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.585 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.74 HG22 ' HB2' ' A' ' 582' ' ' ALA . 80.5 p -129.48 9.76 5.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.733 0.302 . . . . 0.0 111.063 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.542 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 23.2 p -136.47 138.84 41.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.194 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.786 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.47 155.86 36.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.2 m -129.76 125.3 35.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.16 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.5 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.5 mt -121.68 119.61 59.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -107.42 173.64 6.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.03 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.66 59.09 8.05 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.612 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 574' ' ' SER . 12.4 mt -119.01 114.03 21.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.713 0.292 . . . . 0.0 111.005 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -65.21 133.67 52.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.15 173.18 3.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.69 35.32 25.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.049 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.3 m -140.36 142.92 35.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.459 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 t -99.95 111.92 24.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -105.25 127.6 53.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.552 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.622 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.1 OUTLIER -104.44 109.87 21.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.255 179.122 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.405 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 71.5 m-85 -102.19 161.71 13.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.331 0.586 . . . . 0.0 112.222 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.4 p -150.83 148.87 29.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.524 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -110.14 151.64 12.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.052 0.453 . . . . 0.0 111.784 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.0 mttt -139.93 150.18 44.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.006 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.411 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -112.17 121.84 46.07 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.898 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 589' ' ' VAL . 0.0 OUTLIER -115.44 158.42 22.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.25 -179.558 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.03 171.12 8.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.75 60.53 5.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.108 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -158.92 -43.78 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.68 16.37 0.61 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.496 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -111.99 125.11 53.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.339 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 28.4 m -119.67 142.65 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.355 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 31.7 p -77.68 -172.68 2.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.766 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.599 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.01 167.95 20.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.843 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -87.3 128.99 35.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.066 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.444 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.5 t -65.7 179.49 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.61 157.6 26.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.727 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.622 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -89.24 138.5 31.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.16 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.02 108.63 25.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.044 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.08 111.77 17.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.38 129.04 74.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -101.82 115.79 31.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.125 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.744 0.307 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.564 ' HB3' HG22 ' A' ' 589' ' ' VAL . 92.0 Cg_endo -78.32 -158.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.6 2.2 . . . . 0.0 112.42 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 5.3 m -114.31 125.32 53.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.995 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.563 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.2 122.88 66.79 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.04 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.454 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.0 Cg_exo -48.42 159.33 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.539 2.159 . . . . 0.0 112.109 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 564' ' ' THR . . . . . 0.488 HG23 ' OG1' ' A' ' 581' ' ' THR . 0.0 OUTLIER -157.6 169.97 23.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.838 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 59.03 40.46 22.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.048 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.771 HD11 ' HG ' ' A' ' 578' ' ' LEU . 66.2 tp -66.79 157.41 32.97 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.725 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.405 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.36 -179.38 6.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.7 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 6.4 p -134.9 122.54 22.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.077 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.6 p -100.78 -88.2 0.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.745 0.307 . . . . 0.0 111.65 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.22 100.36 11.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.276 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.617 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.1 OUTLIER -118.48 114.15 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.745 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 13.2 p -100.77 -156.87 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.06 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.59 22.45 9.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.363 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 68.0 p -160.02 -49.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -113.28 131.08 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.024 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.617 HG13 ' HB2' ' A' ' 571' ' ' GLN . 17.2 tt -118.6 146.1 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.087 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 31.6 m -104.5 138.77 40.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.755 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.771 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -126.37 133.94 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.3 t -128.47 143.06 50.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.523 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.454 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 41.4 p90 -158.33 169.57 24.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.851 0.358 . . . . 0.0 111.169 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 581' ' ' THR . . . . . 0.488 ' OG1' HG23 ' A' ' 564' ' ' THR . 73.5 p -80.08 114.51 19.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.162 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.9 158.76 6.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.149 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.26 147.55 44.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.96 -5.61 49.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 589' ' ' VAL . 96.2 m-20 -126.35 73.27 1.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.908 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -85.31 18.87 2.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.3 p -81.14 -15.06 12.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.37 -24.31 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.608 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.564 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.8 t -61.67 143.51 14.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.774 0.321 . . . . 0.0 111.207 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 4.7 t -113.48 -15.98 12.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 171.24 -174.54 44.91 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.718 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -131.04 128.85 41.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.075 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.754 ' HB3' HD21 ' A' ' 600' ' ' LEU . 4.2 m-20 -111.14 117.8 34.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.552 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.34 139.0 22.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.999 0.428 . . . . 0.0 111.103 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.437 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.2 m-85 -99.4 150.29 22.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.231 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.405 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 16.8 t30 -113.7 84.53 2.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.961 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.82 -65.45 1.19 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.093 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -154.74 -27.04 0.12 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.755 0.312 . . . . 0.0 111.152 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -100.01 153.07 19.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -58.25 131.34 50.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.937 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -101.35 -105.96 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.552 HG23 HG13 ' A' ' 594' ' ' VAL . 3.8 t -90.49 166.68 13.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.954 0.407 . . . . 0.0 111.416 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 603' ' ' THR . . . . . 0.478 HG23 ' OD1' ' A' ' 593' ' ' ASP . 53.9 m -130.32 124.32 32.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.856 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.2 m -130.59 -177.68 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.293 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.475 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 50.6 p -142.4 -0.86 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -111.79 -144.78 9.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.669 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.6 25.1 11.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.752 0.31 . . . . 0.0 111.168 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -147.27 162.58 38.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.856 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.6 149.99 36.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.737 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 5.1 m -132.45 118.01 18.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.535 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -99.55 136.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.692 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 -172.21 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.962 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.21 -103.29 0.77 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 574' ' ' SER . 1.1 mp 57.86 177.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.027 0.442 . . . . 0.0 111.537 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -169.82 129.22 0.96 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.927 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -55.12 163.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.4 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.54 31.96 21.61 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.234 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.2 148.17 41.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.904 0.383 . . . . 0.0 111.432 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.49 140.13 38.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.515 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -134.89 130.18 35.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.315 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 38.3 p -105.39 108.33 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.149 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -99.9 160.2 14.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.272 0.558 . . . . 0.0 112.085 -178.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.3 p -154.08 136.07 14.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.814 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.564 HG23 ' HB2' ' A' ' 637' ' ' SER . 0.0 OUTLIER -99.41 151.94 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.012 0.434 . . . . 0.0 111.661 -179.346 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 8.4 mmtt -140.42 134.03 30.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.095 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.493 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -92.77 123.41 36.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -117.98 143.86 46.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.041 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -110.5 160.05 16.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.859 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.31 57.59 4.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.093 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.401 ' HB3' ' OD2' ' A' ' 628' ' ' ASP . . . -157.96 -39.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 133.44 32.35 0.39 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.732 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -122.53 100.62 7.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.784 0.326 . . . . 0.0 111.061 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.3 t -99.87 119.02 47.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.493 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 24.8 p -67.29 -173.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.979 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.563 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.97 166.4 21.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.274 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.38 142.7 32.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.564 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -74.65 175.55 7.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.044 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -60.29 150.94 28.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.592 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.87 137.57 36.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -116.94 112.31 38.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.913 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 15.2 t -89.15 109.34 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.0 144.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.84 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.845 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.135 -179.988 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.524 0.202 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -68.52 -169.82 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.407 2.071 . . . . 0.0 112.354 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 59.2 m -87.19 120.29 28.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.691 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.15 129.55 93.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.107 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.01 160.61 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.681 2.254 . . . . 0.0 112.173 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.0 t -145.47 163.69 33.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.309 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 59.68 34.27 22.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.715 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.643 HD21 HD22 ' A' ' 578' ' ' LEU . 2.3 tm? -62.95 119.53 9.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.258 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.41 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -147.61 152.08 37.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 111.334 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.1 p -93.78 137.76 32.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.2 p -107.49 -87.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.53 108.38 19.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.885 179.65 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -123.03 134.55 54.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.141 -179.89 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.453 ' HB ' ' H ' ' A' ' 573' ' ' THR . 25.5 p -108.49 -157.2 0.61 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.453 ' H ' ' HB ' ' A' ' 572' ' ' THR . 0.6 OUTLIER -91.38 -12.23 35.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.324 -179.813 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.422 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.0 p -130.62 -44.87 1.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.298 -179.772 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -101.47 170.78 7.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.03 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.476 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.3 tt -160.44 146.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 87.8 m -118.41 114.04 22.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.824 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.643 HD22 HD21 ' A' ' 566' ' ' LEU . 9.3 mt -101.69 137.76 39.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.068 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 24.5 p -125.59 143.84 50.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.437 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.472 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -155.32 169.72 23.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.365 . . . . 0.0 111.124 -179.704 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.63 139.26 32.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.36 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.63 179.17 2.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.217 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 t -80.92 138.61 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 53.3 p -74.07 -1.14 18.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.657 ' HB3' HG22 ' A' ' 587' ' ' VAL . 0.8 OUTLIER -105.34 -67.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.809 179.868 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 46.7 t30 56.79 24.24 8.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 585' ' ' ASP . 2.3 m -89.29 27.06 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.039 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . 167.34 -9.33 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.41 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 3.6 t -66.46 153.65 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -52.17 0.76 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.419 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.665 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -134.98 179.9 17.18 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.813 -179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -134.75 121.62 20.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.614 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -100.89 126.2 47.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.6 179.757 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.66 142.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.924 0.393 . . . . 0.0 111.266 -179.495 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.577 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 81.0 m-85 -106.0 151.73 24.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.317 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -140.7 97.19 3.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.039 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 56.9 71.59 0.71 Allowed Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.627 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.2 p 47.62 31.07 1.93 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.813 0.339 . . . . 0.0 111.571 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.99 110.3 2.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.775 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.614 HD11 ' HB3' ' A' ' 593' ' ' ASP . 1.6 tt -52.22 133.92 33.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.332 -179.647 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.98 -100.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.868 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.468 ' O ' HG13 ' A' ' 594' ' ' VAL . 14.4 t -90.84 167.53 12.38 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.201 0.524 . . . . 0.0 111.436 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.6 m -135.33 117.24 15.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.522 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 609' ' ' ALA . 18.6 m -117.65 -172.55 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.636 -179.437 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.665 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 6.1 p -143.23 -2.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.14 -117.66 4.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.479 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -16.77 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.696 0.284 . . . . 0.0 111.315 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.487 ' O ' HG11 ' A' ' 604' ' ' VAL . 74.5 p -108.02 167.87 9.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.942 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.681 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.32 128.23 10.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.046 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.4 m -108.66 119.51 39.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.272 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.476 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.5 mp -108.48 138.21 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.3 p -121.13 175.59 6.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.898 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.09 61.51 5.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.667 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 574' ' ' SER . 9.5 mt -131.2 124.78 31.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 110.816 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -77.5 140.21 39.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.98 164.55 26.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.167 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.06 44.59 25.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.057 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.6 m -139.98 149.78 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -86.17 134.65 33.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.549 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -132.75 152.77 51.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.215 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -137.75 104.68 5.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.202 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.514 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 78.5 m-85 -100.52 176.49 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.292 0.568 . . . . 0.0 112.12 -178.927 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -173.73 168.72 4.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.71 179.641 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.472 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -131.16 151.36 35.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.068 0.461 . . . . 0.0 111.634 -179.899 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.531 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 8.9 mmtt -140.7 123.24 16.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.151 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.46 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -79.42 132.88 36.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.096 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -119.97 144.99 47.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.779 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -107.57 166.83 10.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.127 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.24 34.65 0.74 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.191 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.517 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -140.11 4.74 2.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.058 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.93 30.99 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.773 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -114.84 124.74 52.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.665 0.269 . . . . 0.0 110.788 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 12.4 p -116.45 134.53 59.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 111.244 179.928 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.46 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 21.4 p -76.89 -166.11 0.64 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.707 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.691 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -87.69 173.03 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.895 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.531 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -86.49 133.88 33.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.2 -179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.463 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -63.46 178.74 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.922 179.783 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.01 149.23 19.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.384 179.601 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.64 129.0 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.429 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.514 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.9 p -108.38 140.73 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.95 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.52 102.87 12.23 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.396 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.31 114.33 37.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.248 -179.494 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.07 101.07 10.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.613 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 68.3 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.201 -179.822 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.669 0.271 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.32 -159.72 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.457 2.105 . . . . 0.0 112.101 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.1 134.59 52.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.208 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.56 128.82 93.85 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.483 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 83.3 Cg_exo -45.23 136.65 10.88 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.697 2.265 . . . . 0.0 112.074 179.578 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.9 p -119.05 149.67 41.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.7 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 10.0 m120 55.94 61.96 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.483 179.468 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.52 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 33.1 tp -65.71 159.17 25.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.298 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.52 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.03 177.24 10.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.035 0.445 . . . . 0.0 111.636 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 568' ' ' SER . . . . . 0.468 ' HB2' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -133.6 150.74 51.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.465 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -120.52 -90.35 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.447 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.0 97.26 11.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.229 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.468 ' NE2' ' HB2' ' A' ' 568' ' ' SER . 1.5 mp0 -113.72 102.71 10.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.828 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 8.6 p -88.17 -162.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.239 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.65 19.0 7.89 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.661 -179.569 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 8.9 p -158.89 -44.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.79 0.329 . . . . 0.0 111.204 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 65.3 p -113.92 122.2 46.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.425 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.1 tt -109.17 138.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.168 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 14.3 m -112.9 116.11 29.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' A' ' 568' ' ' SER . 59.5 mt -103.73 156.5 17.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.947 0.403 . . . . 0.0 111.182 -179.702 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.1 p -145.0 138.91 27.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.04 179.666 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -144.8 169.83 17.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.971 0.415 . . . . 0.0 111.52 -179.34 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -80.53 126.65 31.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.144 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.21 163.4 4.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.6 t -88.08 133.06 34.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -8.16 37.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.183 179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.1 54.98 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.958 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -71.15 -135.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.674 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.1 t 52.6 20.6 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 121.119 0.485 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -171.1 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.851 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 57.8 t -65.25 117.55 6.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.764 0.316 . . . . 0.0 110.422 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.0 t -101.06 -35.41 9.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.56 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -158.03 178.44 34.31 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.216 -0.992 . . . . 0.0 113.223 -179.616 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -124.94 155.13 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.763 0.315 . . . . 0.0 110.857 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -131.39 117.8 19.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.422 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.446 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.68 143.81 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.916 0.388 . . . . 0.0 111.289 -179.575 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.56 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 92.1 m-85 -108.97 156.2 19.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.45 -179.618 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -118.19 84.04 2.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.152 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.51 -51.43 4.4 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.209 -179.614 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.11 -43.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 0.0 111.125 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -80.06 172.39 13.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.2 tp -90.79 126.98 36.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.322 179.198 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.43 -107.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.859 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.413 HG22 HG13 ' A' ' 611' ' ' ILE . 2.9 t -91.54 164.95 13.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.216 0.532 . . . . 0.0 111.495 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -131.06 106.74 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.332 179.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.694 HG11 ' HA ' ' A' ' 609' ' ' ALA . 34.6 m -111.15 -177.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.638 -179.206 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.56 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.5 p -137.47 -20.08 1.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.795 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -81.15 -116.04 0.37 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.719 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.63 -5.12 2.88 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 -179.653 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.7 p -122.2 156.86 32.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.694 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -134.53 129.74 35.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.4 m -110.02 125.99 53.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.188 -179.865 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.9 mp -111.04 136.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.955 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 82.2 p -113.88 178.0 4.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.24 36.19 92.91 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.447 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.7 OUTLIER -87.88 -174.23 4.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 110.992 -179.903 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -147.29 158.04 43.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -88.91 157.32 18.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.213 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.66 43.37 28.22 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.089 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 10.7 m -140.31 144.13 36.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.457 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.9 p -90.58 140.48 29.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.262 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -135.12 122.66 22.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.828 0.347 . . . . 0.0 111.711 -179.5 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -102.88 105.51 15.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.91 178.852 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.409 ' O ' HG23 ' A' ' 623' ' ' THR . 74.1 m-85 -100.17 176.38 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.399 0.618 . . . . 0.0 112.442 -178.684 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -170.18 155.5 5.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.619 179.669 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.483 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -119.45 159.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.932 0.396 . . . . 0.0 111.538 -179.743 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.571 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.2 mmtt -140.75 113.34 8.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.211 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 633' ' ' VAL . . . -79.51 119.39 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.52 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.418 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -117.83 166.43 12.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.784 179.817 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.15 164.23 20.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.61 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.63 57.38 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.97 -19.02 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.082 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 113.09 26.15 4.18 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.269 -179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.477 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 4.4 m120 -121.81 121.25 36.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.748 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 626' ' ' ALA . 2.3 p -138.91 134.59 42.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.225 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.19 -176.5 3.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.828 179.908 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.472 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -74.68 176.17 7.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.044 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.571 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -73.54 154.72 39.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.078 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.411 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.3 p -79.85 -163.27 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.758 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.79 146.99 41.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.98 23.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.928 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.5 p -102.9 134.53 43.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.262 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.5 m -109.32 105.92 15.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.337 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.24 130.32 63.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.581 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -96.45 121.66 38.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.102 -179.75 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.464 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.577 0.227 . . . . 0.0 111.108 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.22 -165.76 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.642 2.228 . . . . 0.0 112.237 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.33 150.69 19.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.765 179.631 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.595 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -84.11 125.95 71.19 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.416 -179.748 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -48.31 154.57 2.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.686 2.257 . . . . 0.0 112.009 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.26 163.08 33.95 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.07 0.462 . . . . 0.0 111.664 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.94 52.74 11.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.06 179.122 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.675 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 2.0 tp -74.23 156.95 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.051 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.675 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 -177.99 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.518 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 83.9 p -133.76 129.04 36.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.653 179.828 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 76.1 p -111.43 -72.53 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.383 -179.81 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.26 96.3 10.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.351 . . . . 0.0 110.905 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 576' ' ' ILE . 0.7 OUTLIER -123.39 105.64 9.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 17.0 p -85.69 -155.2 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.919 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.0 m -88.04 -37.34 16.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 16.0 p -115.0 -2.61 12.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.669 0.271 . . . . 0.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -133.99 165.41 25.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.954 179.969 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 571' ' ' GLN . 16.4 tt -160.06 148.71 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.526 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.9 m -132.66 124.03 27.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.659 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' A' ' 608' ' ' THR . 23.7 mt -107.47 153.28 23.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.398 . . . . 0.0 111.486 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.7 t -133.38 135.23 44.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.051 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.528 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -143.48 169.89 16.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.473 -179.268 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 m -82.05 115.87 21.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.213 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 582' ' ' ALA . . . . . 0.429 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -62.55 157.25 20.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.018 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.6 146.29 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.757 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 74.5 p -82.56 20.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.126 179.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.17 71.32 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.94 22.25 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -85.45 6.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -155.85 -25.67 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.401 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.8 t -66.26 140.53 19.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.83 0.348 . . . . 0.0 111.173 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 22.3 p -115.48 -51.49 2.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.17 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.564 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -144.24 179.55 21.45 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.597 -179.947 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -131.28 120.36 23.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 111.016 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.521 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -99.75 122.17 42.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.419 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -102.01 138.17 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.971 0.415 . . . . 0.0 111.267 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.719 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 96.1 m-85 -99.27 162.04 13.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.655 179.912 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -140.32 88.96 2.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 62.55 69.02 1.42 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.995 -179.463 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p 50.23 35.02 9.59 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.008 0.432 . . . . 0.0 111.115 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.31 102.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.775 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.71 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -48.87 122.99 6.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.291 -179.654 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -92.89 -98.95 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.198 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.8 169.07 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.133 0.492 . . . . 0.0 111.669 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.16 109.07 6.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.455 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.731 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -108.42 -170.59 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.789 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.564 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 32.0 p -140.51 2.47 1.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.834 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.1 -134.05 5.56 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.475 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.429 HG22 ' HB2' ' A' ' 582' ' ' ALA . 52.5 p -112.5 -4.03 14.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.768 0.318 . . . . 0.0 111.238 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.518 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.4 p -119.1 152.75 35.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.122 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.731 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.26 124.02 22.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 9.2 m -106.56 134.41 49.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.347 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.445 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.4 mp -121.01 138.6 50.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 14.1 m -117.76 162.36 18.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.793 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.49 79.1 0.22 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.321 -179.761 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 614' ' ' LEU . 1.2 tp -135.18 154.86 51.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 111.081 -179.755 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -92.05 163.36 14.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.059 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -89.52 156.9 18.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.912 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 2.6 p30 40.57 58.09 2.44 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.504 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 618' ' ' THR . . . . . 0.446 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 3.6 m -134.29 148.68 50.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.077 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 78.9 p -87.06 130.21 34.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.746 179.845 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 620' ' ' TYR . . . . . 0.446 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 69.5 m-85 -134.63 135.21 41.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.959 0.409 . . . . 0.0 111.645 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 43.3 p -114.62 128.13 56.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.857 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.483 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 76.2 m-85 -120.08 168.94 10.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.458 0.647 . . . . 0.0 112.274 -178.889 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -167.42 152.67 7.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.314 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.56 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -118.97 155.86 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 112.266 -179.266 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.719 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 5.7 mmtp -140.77 142.68 34.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.757 -179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.54 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -101.33 128.2 47.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.489 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.52 140.29 50.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 179.65 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.61 167.99 9.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.75 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -66.36 -31.32 72.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.89 -179.265 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.2 10.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.569 -179.38 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 76.81 69.82 1.35 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.508 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 71.6 m-80 -148.2 124.04 10.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.685 0.278 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 25.7 m -112.59 139.44 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.044 0.45 . . . . 0.0 111.693 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.54 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 2.0 p -83.8 -164.93 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.248 179.592 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.595 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.94 161.33 23.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.73 0.3 . . . . 0.0 110.814 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.639 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -74.1 144.23 45.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.865 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.416 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -72.15 -163.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.19 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.27 142.09 34.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.844 179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.483 ' HA ' ' O ' ' A' ' 622' ' ' PHE . . . -79.65 116.22 19.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.065 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 621' ' ' THR . 11.6 p -101.03 131.82 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.129 -179.942 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 45.8 t -106.28 113.78 27.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.1 147.75 26.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.432 -179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -111.46 116.07 30.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.856 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.183 179.967 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.708 0.29 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -83.34 -158.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.731 2.288 . . . . 0.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 3.4 m -115.91 133.94 55.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.067 179.856 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.54 127.33 92.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.247 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.36 163.63 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.737 2.292 . . . . 0.0 112.003 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.2 t -155.07 158.43 39.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.366 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.2 m120 58.36 49.63 10.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.287 179.715 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.797 HD11 ' HG ' ' A' ' 578' ' ' LEU . 6.1 tp -71.16 158.49 36.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.306 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.641 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 174.51 13.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 0.0 111.475 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.9 142.8 50.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.619 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.13 -78.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.277 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 570' ' ' ALA . . . . . 0.532 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -88.67 96.53 10.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.186 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -115.03 97.6 6.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.92 179.873 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 61.1 p -92.63 -163.61 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 46.2 p -90.52 24.97 2.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.353 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 614' ' ' LEU . 24.9 p -163.83 -49.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.017 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -101.06 160.14 14.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.945 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.458 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.5 tt -151.18 137.08 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.926 0.394 . . . . 0.0 111.176 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 577' ' ' THR . . . . . 0.532 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.8 m -106.17 131.36 53.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.567 179.63 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.797 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -120.81 128.24 52.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.532 -179.208 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.6 t -123.73 128.34 49.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.405 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.599 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.6 p90 -140.64 170.21 16.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.959 0.409 . . . . 0.0 111.456 -179.355 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.3 m -79.6 123.02 27.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.143 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.58 162.63 8.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.22 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 7.4 m -71.46 158.2 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 17.45 3.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.614 ' O ' HG23 ' A' ' 589' ' ' VAL . 1.6 t70 -138.5 44.22 2.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.799 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -60.79 -12.87 12.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.162 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.7 -9.92 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.041 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.0 -29.82 0.6 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.569 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 585' ' ' ASP . 7.4 t -65.31 145.48 13.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.644 0.259 . . . . 0.0 110.874 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.4 t -117.64 -34.32 4.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.477 -179.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.716 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -157.46 169.43 34.4 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.16 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -122.63 126.15 47.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.727 0.298 . . . . 0.0 110.763 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 1.3 m-20 -101.54 116.62 33.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.632 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.62 HG13 ' HB ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.32 139.95 19.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.982 0.42 . . . . 0.0 111.106 -179.599 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -102.21 146.58 27.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.278 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 0.2 OUTLIER -101.67 84.59 2.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.179 179.105 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.13 -55.82 4.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.349 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.5 p -147.56 -56.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.774 0.321 . . . . 0.0 111.033 179.86 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.69 174.12 11.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 154.15 25.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.906 0.384 . . . . 0.0 110.986 -179.944 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -141.08 -68.68 0.39 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.135 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.62 ' HB ' HG13 ' A' ' 594' ' ' VAL . 0.1 OUTLIER -90.76 154.88 19.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.133 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.23 89.34 2.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.423 178.699 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.808 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.9 m -104.03 -176.03 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.613 -179.322 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.716 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.6 p -144.41 -11.56 0.62 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.111 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -96.91 -137.67 9.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.628 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.89 10.05 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.641 0.258 . . . . 0.0 111.396 -179.828 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -137.11 165.55 25.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.315 -179.902 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.808 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -141.8 150.91 42.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.158 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.6 m -134.43 118.33 17.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.303 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.458 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.5 mp -117.88 111.81 35.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.0 154.01 21.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.988 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.64 33.64 5.53 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.601 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 574' ' ' SER . 3.6 mt -107.58 155.8 19.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.783 0.325 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.68 159.97 15.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.95 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.02 179.58 5.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.401 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.18 28.39 17.68 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.077 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.15 150.47 44.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.468 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 75.3 m -100.64 121.08 41.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.29 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -114.46 129.39 56.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.993 0.425 . . . . 0.0 111.897 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.5 OUTLIER -108.75 121.91 46.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.787 178.907 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.23 165.15 12.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.381 0.61 . . . . 0.0 112.395 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 7.0 p -150.44 149.99 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.709 179.27 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.599 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -117.01 152.78 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.955 0.407 . . . . 0.0 111.523 -179.769 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.7 mttt -140.62 139.79 34.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.204 -179.654 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -99.04 121.96 41.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.449 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.84 140.46 49.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.987 -179.813 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 628' ' ' ASP . . . . . 0.446 ' OD1' HG22 ' A' ' 589' ' ' VAL . 9.1 m-20 -105.2 175.01 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.893 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.95 15.29 4.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.293 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -113.26 6.45 17.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.976 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 80.11 9.9 86.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.475 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -102.14 125.38 48.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.89 137.94 56.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.093 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.1 -167.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.163 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.08 178.9 7.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.061 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.483 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.2 146.86 23.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.05 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.422 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.1 t -79.09 174.71 11.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -59.3 148.29 32.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.801 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -81.3 126.67 31.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.575 ' O ' ' HA ' ' A' ' 621' ' ' THR . 5.3 p -99.5 134.11 39.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.554 179.702 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.87 113.34 26.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 111.056 -179.398 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.409 HG21 ' CD1' ' A' ' 576' ' ' ILE . 0.4 OUTLIER -122.95 131.34 73.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.901 179.826 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.39 113.99 25.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.2 -179.93 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -68.5 -172.66 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.527 2.151 . . . . 0.0 112.311 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 18.2 p -99.93 135.45 41.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.405 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.419 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -64.12 132.24 95.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.128 179.769 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB2' ' HB2' ' A' ' 637' ' ' SER . 81.0 Cg_exo -45.47 153.74 0.63 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.616 2.21 . . . . 0.0 112.226 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.29 151.05 44.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.943 0.401 . . . . 0.0 111.62 -179.577 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 59.39 59.71 2.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.969 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.715 HD11 ' HG ' ' A' ' 578' ' ' LEU . 63.9 tp -74.83 159.95 31.28 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.891 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.417 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.34 173.35 15.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.021 0.438 . . . . 0.0 111.934 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.71 129.11 36.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.307 179.381 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.8 p -106.36 -84.23 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 111.643 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.8 96.92 10.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.461 -179.426 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.446 ' NE2' HG13 ' A' ' 642' ' ' VAL . 0.2 OUTLIER -116.0 101.65 8.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.793 179.752 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.5 p -90.78 -157.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.072 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 40.5 p -95.24 25.21 4.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.465 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 78.8 p -167.36 -50.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.278 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.55 131.54 53.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.146 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.64 HD12 HG11 ' A' ' 642' ' ' VAL . 10.0 tt -121.99 143.31 35.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -107.15 117.01 32.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.579 179.662 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -108.63 134.99 50.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.149 -179.526 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -130.01 136.52 49.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.474 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.1 p90 -148.59 169.78 19.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.902 0.382 . . . . 0.0 111.122 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 5.5 m -82.14 116.52 21.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.963 179.684 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.25 155.25 21.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.048 179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 m -59.46 120.61 9.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.79 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -15.96 61.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.9 -66.14 0.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.865 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.484 ' O ' HG12 ' A' ' 587' ' ' VAL . 49.5 t30 57.71 -133.69 1.19 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.772 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.484 HG12 ' O ' ' A' ' 586' ' ' ASN . 3.8 p 45.1 23.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 111.655 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.44 -21.13 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.084 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.7 t -76.34 134.18 29.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.789 0.328 . . . . 0.0 110.713 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.89 -48.22 4.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.314 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.12 -179.35 26.77 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.87 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -126.42 132.5 51.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.36 123.19 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.389 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.86 137.57 26.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.889 0.376 . . . . 0.0 111.228 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.413 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 93.0 m-85 -99.47 145.39 27.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.513 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 12.7 t30 -114.92 89.74 3.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.368 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.56 -70.9 3.02 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.129 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.5 p -148.11 -16.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.865 0.364 . . . . 0.0 110.888 179.73 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -115.53 134.75 54.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 179.602 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.403 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -48.35 147.67 2.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.345 -179.747 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.513 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -115.33 -106.65 0.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.173 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.5 t -90.92 168.07 11.96 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.205 0.526 . . . . 0.0 111.854 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -128.92 130.84 47.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.313 179.756 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.6 m -132.77 -177.7 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.501 -179.365 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.521 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 34.7 p -145.53 17.67 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.974 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -128.05 -121.85 2.44 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.761 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.95 9.3 5.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.627 0.251 . . . . 0.0 111.41 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.1 p -139.72 140.08 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.36 -179.879 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -122.48 148.0 45.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.5 m -122.01 109.08 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.278 -179.896 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.462 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -102.34 126.71 56.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.096 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 164.97 13.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.864 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.85 47.78 5.18 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.473 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.5 mt -119.38 152.25 37.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 110.918 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.7 152.12 35.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.151 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -77.93 174.91 10.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.4 t0 56.86 25.55 10.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.14 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.72 161.57 32.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.054 179.827 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 47.5 t -121.94 137.28 54.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.82 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -135.62 172.54 12.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.943 0.401 . . . . 0.0 111.491 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.55 110.65 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.105 179.496 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.408 ' O ' HG23 ' A' ' 623' ' ' THR . 78.6 m-85 -99.73 165.65 11.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.227 0.537 . . . . 0.0 111.959 -178.928 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.408 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.8 OUTLIER -159.62 153.07 22.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.882 179.628 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.474 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -118.57 150.12 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.924 0.392 . . . . 0.0 111.345 -179.763 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.413 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.3 mttt -136.0 150.16 49.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.083 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -106.26 129.27 54.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.223 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.637 ' HB3' HG12 ' A' ' 633' ' ' VAL . 1.9 ptmm? -127.78 142.62 51.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.28 169.72 8.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 179.848 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.62 48.7 1.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.74 3.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.084 179.934 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.84 61.81 1.74 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.458 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.8 m120 -145.48 106.98 4.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.646 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 633' ' ' VAL . . . . . 0.637 HG12 ' HB3' ' A' ' 627' ' ' LYS . 29.4 m -118.82 137.98 51.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.378 -179.823 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.419 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -87.95 -167.0 1.74 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.718 179.808 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -73.0 170.95 13.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.14 138.78 33.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.465 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.51 179.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.234 -179.847 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.24 148.44 27.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.69 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.97 128.39 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.003 -179.893 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.3 m -109.73 115.08 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.268 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 19.6 m -79.81 100.95 8.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.287 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.64 HG11 HD12 ' A' ' 576' ' ' ILE . 63.6 t -99.86 108.79 23.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.37 -179.458 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 95.0 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 19.8 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.18 -179.902 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.63 0.252 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.45 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.562 2.175 . . . . 0.0 111.958 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.831 HG23 ' HB2' ' A' ' 585' ' ' ASP . 2.2 p -107.52 136.88 46.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.889 0.376 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.423 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -67.18 129.9 93.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.305 -179.783 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.458 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 85.3 Cg_exo -47.28 152.48 2.21 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.729 2.286 . . . . 0.0 111.854 179.277 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.96 161.76 34.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.34 -179.652 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 61.1 34.05 19.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.938 179.639 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.779 HD21 HD22 ' A' ' 578' ' ' LEU . 1.6 tm? -69.15 117.51 10.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.117 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.494 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -144.74 145.97 31.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.232 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 2.1 p -84.83 150.74 24.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 179.92 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 6.2 p -124.29 -86.43 0.63 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.277 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.9 99.46 12.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.014 -179.926 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.485 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.6 tt0 -119.43 140.13 50.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.043 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 36.5 p -128.45 -167.85 1.83 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.895 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 6.1 p -87.38 32.98 0.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.189 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 23.2 p -169.46 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.315 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -110.69 135.97 50.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.248 -179.677 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.485 HD12 ' HG3' ' A' ' 571' ' ' GLN . 13.8 tt -127.71 139.32 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.78 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 20.7 m -110.27 122.2 47.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.135 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.779 HD22 HD21 ' A' ' 566' ' ' LEU . 13.1 mt -109.1 141.47 41.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.969 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.5 t -132.29 133.54 44.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.559 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -144.76 169.66 17.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.198 -179.599 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.7 m -84.69 128.25 34.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.199 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.24 25.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.047 179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 94.5 p -61.49 150.19 36.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.899 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 30.7 p -85.61 11.64 10.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.01 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.831 ' HB2' HG23 ' A' ' 561' ' ' THR . 0.4 OUTLIER -119.38 45.08 2.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.923 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.44 ' C ' ' H ' ' A' ' 588' ' ' GLY . 73.1 m-20 -65.11 -164.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.962 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 11.2 t 66.41 -4.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.118 0.485 . . . . 0.0 110.906 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 588' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -142.24 -16.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 585' ' ' ASP . 89.3 t -82.49 146.57 6.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.67 0.272 . . . . 0.0 110.781 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 590' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 591' ' ' GLY . 1.3 t -106.08 -54.41 2.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.638 -179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -151.71 -172.21 20.28 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.137 -179.563 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -131.01 129.26 41.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.791 0.329 . . . . 0.0 110.586 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.18 117.67 34.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.548 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.83 137.01 28.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.804 -179.892 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 33.9 m-85 -101.9 175.06 5.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.315 -179.444 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.44 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 18.2 t30 -140.48 89.3 2.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.737 179.666 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 85.32 -68.84 3.38 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.305 -179.736 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.406 ' H ' ' H ' ' A' ' 599' ' ' ALA . 1.1 p -150.3 -18.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.902 0.382 . . . . 0.0 110.638 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 599' ' ' ALA . . . . . 0.406 ' H ' ' H ' ' A' ' 598' ' ' THR . . . -114.6 135.25 54.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.6 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.1 tp -51.94 144.22 12.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.218 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.44 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -110.96 -98.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.101 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.548 HG23 HG13 ' A' ' 594' ' ' VAL . 2.9 t -90.83 160.2 15.87 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.108 0.48 . . . . 0.0 111.645 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 15.9 m -125.97 122.62 36.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.167 179.551 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.755 HG11 ' HA ' ' A' ' 609' ' ' ALA . 30.1 m -127.83 -174.74 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.062 0.458 . . . . 0.0 111.998 -178.918 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.523 HG22 ' HA3' ' A' ' 591' ' ' GLY . 6.2 p -146.59 -2.29 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.889 179.843 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.49 -134.15 6.64 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.717 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.47 30.16 7.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.776 0.322 . . . . 0.0 111.242 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.489 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -157.77 141.17 15.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.215 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.755 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.78 155.97 36.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.81 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 16.6 m -137.06 124.51 22.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.241 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.449 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 4.7 mp -113.68 128.34 70.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.96 171.08 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 61.02 64.81 3.74 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.675 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.4 OUTLIER -115.51 132.44 56.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.828 0.347 . . . . 0.0 110.868 -179.989 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -99.44 134.72 41.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.116 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.12 168.23 16.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 16.2 t0 59.66 29.08 18.63 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.019 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.9 m -134.79 142.23 46.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.168 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 26.3 t -84.09 143.66 29.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.738 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 620' ' ' TYR . . . . . 0.415 ' HB2' HG23 ' A' ' 642' ' ' VAL . 59.8 m-85 -136.87 142.35 42.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.151 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.4 p -132.57 114.2 13.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.289 179.447 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.546 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 81.3 m-85 -109.13 166.88 10.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.283 0.563 . . . . 0.0 111.905 -179.203 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 623' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.2 OUTLIER -169.26 127.17 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.693 179.603 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.526 HG23 ' HG ' ' A' ' 566' ' ' LEU . 0.6 OUTLIER -99.36 149.55 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.491 . . . . 0.0 111.926 -179.056 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.1 mttt -128.24 166.36 18.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.332 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -116.06 123.78 48.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -121.38 154.44 36.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.829 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 171.74 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.57 47.69 1.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.361 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -153.92 -30.85 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.056 179.86 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 125.11 28.25 1.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.573 179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -112.7 120.29 41.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.77 0.319 . . . . 0.0 110.702 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.7 147.75 24.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.33 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.3 t -89.95 -154.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.524 179.68 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.423 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -84.0 -179.5 7.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 179.725 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.548 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.15 140.3 29.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.371 . . . . 0.0 111.023 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.458 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 4.9 p -68.45 -172.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.014 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.71 145.37 52.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.747 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.421 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -80.17 119.19 22.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.167 -179.902 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.3 p -101.12 123.95 54.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.041 179.855 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.3 t -105.58 106.14 16.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.862 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 620' ' ' TYR . 0.1 OUTLIER -113.36 125.45 70.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.259 179.991 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.92 101.68 12.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 70.9 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.254 -179.963 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.472 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.721 0.296 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.506 ' HB3' HG22 ' A' ' 589' ' ' VAL . 69.1 Cg_endo -74.09 -168.74 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.512 2.141 . . . . 0.0 111.817 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.765 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 70.2 m -109.81 113.27 25.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.173 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.33 64.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.737 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 86.4 Cg_exo -46.98 160.33 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.602 2.201 . . . . 0.0 112.381 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.8 t -155.28 157.81 37.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.555 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 11.3 t30 58.46 43.16 19.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.432 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.759 HD11 ' HG ' ' A' ' 578' ' ' LEU . 51.7 tp -61.45 160.58 10.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.303 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.441 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.21 173.7 14.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 111.774 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.6 p -126.13 136.31 52.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.6 p -110.65 -86.88 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.534 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.16 98.5 11.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.819 0.342 . . . . 0.0 111.348 -179.76 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.409 ' HB3' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.12 104.09 10.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.844 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.8 p -103.83 -170.08 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 71.5 p -91.74 41.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.6 p -168.65 -42.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.259 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -135.28 137.47 42.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.136 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.594 HG22 ' HB ' ' A' ' 611' ' ' ILE . 13.7 tt -118.67 142.48 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.247 179.931 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.5 m -110.82 121.63 45.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.622 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.759 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -111.36 136.08 51.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.085 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.3 t -130.94 135.38 47.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.613 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.4 p90 -143.71 170.18 16.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.985 0.421 . . . . 0.0 111.428 -179.334 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.45 116.65 19.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.019 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 582' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -60.74 170.06 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.266 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.765 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 2.6 p -88.33 138.91 31.02 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.996 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -13.94 62.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.337 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 589' ' ' VAL . 27.9 m-20 -110.03 59.23 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.846 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -78.24 5.2 10.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.2 p -67.57 -18.98 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.799 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -120.79 -24.98 2.43 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 179.901 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 560' ' ' PRO . 3.5 t -69.6 133.85 31.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.906 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.9 t -120.28 0.52 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.439 -179.665 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.644 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.63 162.81 23.61 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.253 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -122.05 145.56 48.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.811 0.338 . . . . 0.0 110.746 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.581 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -123.03 124.54 43.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.723 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.553 ' CG1' HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -101.18 132.6 46.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.035 0.445 . . . . 0.0 111.032 -179.942 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.743 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 97.3 m-85 -99.74 149.31 23.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.954 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -131.35 100.4 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.757 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.9 69.52 1.24 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.332 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 68.1 p 48.41 29.51 2.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.925 0.393 . . . . 0.0 111.353 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -154.8 103.75 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.599 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.743 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -48.47 139.4 9.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.526 -179.451 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.38 -94.65 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.792 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.553 HG23 ' CG1' ' A' ' 594' ' ' VAL . 0.9 OUTLIER -91.07 163.13 14.41 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.111 0.481 . . . . 0.0 111.443 179.83 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 99.57 4.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.421 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.73 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.2 m -103.16 -167.88 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.648 -179.203 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.644 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.0 p -143.51 -24.03 0.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.014 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -83.33 -124.6 0.98 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.618 -179.921 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 0.5 OUTLIER -126.21 9.54 7.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 111.12 -179.875 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.551 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -131.19 157.63 42.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.246 -179.998 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.73 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.46 142.7 30.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.583 179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.5 OUTLIER -125.24 131.2 53.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.557 -179.697 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.594 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.2 mp -115.83 130.39 70.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.131 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 3.2 p -99.37 -178.07 3.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.783 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 56.44 45.7 88.84 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.37 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 614' ' ' LEU . 6.1 tp -97.66 148.06 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 111.133 -179.769 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.74 165.55 13.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 174.04 7.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.362 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 43.32 44.04 4.49 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.946 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.16 151.55 45.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.281 179.53 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -108.63 132.54 53.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.536 179.618 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -126.6 136.87 53.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.91 0.386 . . . . 0.0 111.411 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.37 116.26 31.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.087 179.094 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -114.0 163.6 14.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.255 0.55 . . . . 0.0 112.233 -178.932 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -155.72 147.18 22.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.645 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.613 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -109.95 152.65 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -179.625 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.565 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 4.9 mmtt -135.79 145.68 46.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.089 -179.531 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.484 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -109.98 115.68 30.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.435 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 2.0 pttm -117.95 152.1 36.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.111 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -99.74 -159.3 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -51.56 -76.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.071 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.86 48.51 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.466 179.954 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -148.18 -66.06 0.01 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.42 -179.726 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 7.8 m120 -89.89 145.11 25.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.205 0.526 . . . . 0.0 111.811 -179.091 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.2 t -137.95 135.74 45.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 179.35 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 626' ' ' ALA . 0.6 OUTLIER -89.15 173.88 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.178 -179.513 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.444 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -82.39 171.65 13.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.212 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.484 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.14 143.36 32.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.1 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -174.45 3.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -70.55 152.0 44.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.562 179.744 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.71 149.42 29.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.026 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.12 111.05 23.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.373 -179.888 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.0 t -89.29 112.57 23.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.68 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.28 140.52 31.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.09 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.34 100.79 10.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.845 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.102 179.977 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.661 0.267 . . . . 0.0 111.347 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.418 ' HB2' ' H ' ' A' ' 561' ' ' THR . 86.9 Cg_endo -83.27 -140.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.695 2.263 . . . . 0.0 112.137 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.418 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -115.34 122.27 45.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.806 0.336 . . . . 0.0 110.853 179.661 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.16 129.88 86.55 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.282 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 87.7 Cg_exo -45.8 125.39 8.01 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.66 2.24 . . . . 0.0 111.887 179.561 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 2.8 t -109.53 149.83 29.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.637 -179.431 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 m120 57.41 78.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.796 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.513 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 36.9 tp -90.35 159.27 16.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.303 179.118 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.513 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.61 14.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.974 0.416 . . . . 0.0 111.649 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 77.6 p -124.65 143.26 50.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.326 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.31 -89.84 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.714 0.292 . . . . 0.0 111.77 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.71 103.15 11.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.602 -179.422 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.7 134.56 54.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.757 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.403 ' HB ' ' H ' ' A' ' 573' ' ' THR . 18.5 p -129.62 -161.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.793 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.403 ' H ' ' HB ' ' A' ' 572' ' ' THR . 16.7 p -96.77 27.49 3.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 88.5 p -168.65 -40.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.333 179.985 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -115.99 153.33 31.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.237 -179.651 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.4 tt -144.78 149.11 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.912 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 71.2 m -128.36 111.61 13.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 91.9 mt -100.45 141.46 33.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.102 -179.793 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 579' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 607' ' ' THR . 22.6 t -124.8 140.43 52.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.394 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.46 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 48.3 p90 -154.55 169.79 22.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.11 -179.568 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.4 m -84.55 122.38 28.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.862 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.17 160.49 3.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.147 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.2 m -56.72 158.91 4.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 32.2 p -96.97 12.79 31.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.573 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.469 ' OD2' HG23 ' A' ' 589' ' ' VAL . 5.8 p-10 -105.78 -57.98 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.143 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 586' ' ' ASN . . . . . 0.409 ' N ' ' CG ' ' A' ' 585' ' ' ASP . 0.1 OUTLIER 48.98 24.13 0.82 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.783 0.325 . . . . 0.0 111.364 179.914 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 585' ' ' ASP . 12.5 m -98.31 -2.86 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.052 0.453 . . . . 0.0 110.995 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -165.0 -8.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.844 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.469 HG23 ' OD2' ' A' ' 585' ' ' ASP . 16.4 t -65.27 128.75 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.866 0.365 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.78 -30.5 5.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.277 -179.839 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.69 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -161.67 174.26 38.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.729 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -125.98 125.79 43.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.867 0.365 . . . . 0.0 110.905 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.504 ' OD1' HD11 ' A' ' 600' ' ' LEU . 2.3 m-20 -100.03 119.11 37.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.6 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.83 135.41 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.006 0.432 . . . . 0.0 111.185 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.697 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.2 m-85 -99.88 129.71 45.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.982 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 596' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 21.7 t30 -109.93 89.16 2.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.586 179.649 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 68.45 72.34 0.83 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 27.0 p 46.66 30.04 1.07 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.952 0.406 . . . . 0.0 111.334 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.07 106.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.763 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.697 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 7.7 tt -47.1 138.81 6.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.449 -179.641 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 601' ' ' ALA . . . . . 0.429 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -114.39 -92.11 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.0 179.816 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.6 t -90.69 168.01 12.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.256 0.551 . . . . 0.0 111.676 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 43.5 m -138.61 108.5 6.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.348 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.3 m -105.86 -168.17 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.351 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.69 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.4 p -143.06 -12.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.82 -135.49 8.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.549 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 607' ' ' THR . . . . . 0.446 ' O ' ' HA ' ' A' ' 579' ' ' SER . 70.2 p -111.3 5.13 19.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.775 0.321 . . . . 0.0 111.238 -179.896 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 2.3 p -115.38 164.14 14.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.701 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -150.93 115.85 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.733 0.301 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.6 m -102.56 121.37 42.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.154 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.0 mt -120.7 121.77 66.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 -179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 80.2 p -101.01 174.6 5.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.774 179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.89 58.38 10.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.362 -179.818 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.1 OUTLIER -120.21 133.36 55.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.861 0.362 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -74.58 160.91 30.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.232 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.11 147.01 23.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 52.97 52.95 12.84 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.1 m -134.34 142.4 47.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.175 -179.791 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.8 t -79.72 137.44 37.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.45 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -139.17 134.61 33.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.476 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.459 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.84 113.48 23.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.043 179.119 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 622' ' ' PHE . . . . . 0.473 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 63.1 m-85 -108.14 160.77 15.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.355 0.598 . . . . 0.0 112.372 -178.731 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.86 130.36 8.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.834 179.557 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.48 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.1 OUTLIER -99.61 152.03 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.168 0.509 . . . . 0.0 111.724 -179.242 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.573 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 11.6 mttt -140.73 142.3 34.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.986 -179.811 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -102.19 122.92 45.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.127 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 627' ' ' LYS . . . . . 0.452 ' HD3' ' OD2' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -114.35 149.88 35.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 179.825 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -105.76 -179.17 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.2 37.14 0.89 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.864 179.77 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -144.23 6.3 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.62 16.45 70.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.457 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.49 111.59 24.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.746 0.308 . . . . 0.0 110.789 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 10.6 p -110.34 144.38 18.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.242 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.9 -162.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.012 -179.874 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.84 178.39 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.103 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.33 147.45 23.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.294 -179.818 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 637' ' ' SER . . . . . 0.435 ' CB ' HG23 ' A' ' 624' ' ' VAL . 8.2 t -78.61 -177.11 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.755 179.837 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.09 142.71 58.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.535 179.682 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.459 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -79.93 120.01 23.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.955 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.527 HG22 HG13 ' A' ' 642' ' ' VAL . 7.5 p -100.26 126.88 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.186 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.32 93.17 4.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.479 179.801 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.527 HG13 HG22 ' A' ' 640' ' ' VAL . 15.5 m -99.72 155.45 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.238 -179.725 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.26 118.15 33.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.768 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.081 179.945 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.561 0.219 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.589 ' HB3' HG22 ' A' ' 589' ' ' VAL . 27.8 Cg_endo -62.9 175.85 2.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.44 2.093 . . . . 0.0 112.243 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 561' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 583' ' ' SER . 27.1 m -83.3 135.35 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.285 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.683 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -70.23 127.16 92.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.586 -179.774 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.44 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 60.4 Cg_exo -51.45 162.01 1.65 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.831 2.354 . . . . 0.0 111.838 179.261 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 8.1 t -159.56 169.41 23.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.279 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 57.82 33.79 23.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.348 179.653 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.83 HD11 ' HG ' ' A' ' 578' ' ' LEU . 53.9 tp -60.51 158.73 11.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.316 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.451 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.42 14.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.406 . . . . 0.0 111.553 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.9 p -129.43 127.48 41.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.372 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.57 -84.18 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.722 -179.53 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.71 97.0 9.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.44 -179.591 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.433 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.5 OUTLIER -118.63 106.41 12.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.718 179.703 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 39.3 p -95.65 -156.63 0.53 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.025 179.972 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.2 p -99.34 24.15 8.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.453 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.412 ' O ' HD12 ' A' ' 614' ' ' LEU . 87.4 p -163.95 -42.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.135 -179.972 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.515 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.7 OUTLIER -119.04 128.63 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.256 -179.661 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.47 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.4 tt -119.06 146.47 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 34.6 m -112.19 131.56 55.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.594 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.83 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -117.9 146.75 43.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.267 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 579' ' ' SER . . . . . 0.487 ' O ' HD12 ' A' ' 566' ' ' LEU . 12.5 t -140.91 140.2 34.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.471 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.498 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -155.55 169.77 23.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.256 -179.596 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.9 126.17 32.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.119 179.905 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.77 5.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.157 -179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 561' ' ' THR . 3.3 p -72.62 157.49 37.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.7 -2.84 58.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 45.0 m-20 -123.18 54.39 1.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 -179.99 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -74.33 1.5 11.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 587' ' ' VAL . . . . . 0.427 HG23 ' H ' ' A' ' 587' ' ' VAL . 3.2 t -60.63 -14.58 9.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.318 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -135.32 -20.04 0.74 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.666 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.589 HG22 ' HB3' ' A' ' 560' ' ' PRO . 23.1 t -56.71 148.42 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.676 0.274 . . . . 0.0 110.984 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 19.6 p -130.59 -22.49 2.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.822 -179.565 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.64 179.09 40.17 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.041 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 592' ' ' TYR . . . . . 0.412 ' CD2' ' HA ' ' A' ' 626' ' ' ALA . 85.9 m-85 -137.12 123.52 20.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.633 0.254 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.616 ' OD1' HD12 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -99.65 128.55 45.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.443 179.467 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.493 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -103.4 131.65 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.854 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 95.8 m-85 -99.43 150.44 22.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.651 -179.722 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -134.05 93.53 3.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.653 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.25 73.79 0.39 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.328 -179.676 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.6 p 47.97 35.93 5.62 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.875 0.369 . . . . 0.0 111.405 -179.68 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.98 104.59 1.53 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.122 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.616 HD12 ' OD1' ' A' ' 593' ' ' ASP . 2.0 tt -49.54 121.23 4.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.063 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.2 -101.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.199 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 602' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 611' ' ' ILE . 4.5 t -90.67 169.95 10.56 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.18 0.514 . . . . 0.0 111.574 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.77 113.94 12.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.362 179.761 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.706 HG11 ' HA ' ' A' ' 609' ' ' ALA . 9.9 m -113.71 -175.17 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.621 -179.172 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.535 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -145.26 7.6 1.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.807 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.38 -120.68 3.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.649 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.49 -14.53 7.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.69 0.281 . . . . 0.0 111.338 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG21 ' A' ' 604' ' ' VAL . 67.6 p -114.09 175.02 5.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.706 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -157.76 126.18 5.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.6 OUTLIER -111.47 133.48 53.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.907 0.384 . . . . 0.0 111.46 -179.66 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.4 mp -114.82 135.13 55.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -102.8 178.5 4.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 72.78 -84.75 0.56 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.427 -179.956 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.494 HD22 HG21 ' A' ' 644' ' ' THR . 5.0 mt 49.58 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 120.9 0.381 . . . . 0.0 111.625 179.348 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 615' ' ' ALA . . . . . 0.452 ' HB3' ' OH ' ' A' ' 620' ' ' TYR . . . -168.31 111.27 0.59 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.83 179.938 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -60.4 168.76 1.95 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.493 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.73 28.5 17.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.284 179.821 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.44 148.21 40.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.335 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.49 135.0 33.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.452 179.547 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 620' ' ' TYR . . . . . 0.452 ' OH ' ' HB3' ' A' ' 615' ' ' ALA . 57.6 m-85 -126.54 146.68 50.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.24 0.543 . . . . 0.0 111.981 -179.474 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.15 103.28 6.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -99.47 165.07 11.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.359 0.6 . . . . 0.0 112.031 -178.668 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.6 p -151.96 162.9 40.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 179.353 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.706 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -125.92 153.6 34.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.953 0.406 . . . . 0.0 111.548 -179.8 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.532 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.7 mmtt -140.36 124.63 17.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.047 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 626' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 592' ' ' TYR . . . -82.8 100.62 10.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.559 179.622 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.72 155.08 17.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.012 0.434 . . . . 0.0 111.163 -179.547 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.67 -156.7 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.211 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -49.56 -78.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.647 0.261 . . . . 0.0 111.263 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -161.06 48.35 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.517 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -169.62 9.25 0.05 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.755 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -152.43 131.41 12.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.262 0.531 . . . . 0.0 111.254 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.43 124.47 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.735 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 634' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 93.0 p -67.81 -164.55 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.935 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.683 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.44 169.72 10.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.994 179.781 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.4 137.7 32.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.888 179.687 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.7 p -73.56 -167.53 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.08 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -70.89 166.95 20.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.96 131.97 40.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.329 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.21 110.76 33.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.218 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 641' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 620' ' ' TYR . 0.3 OUTLIER -88.73 118.5 28.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.85 -179.937 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.19 127.46 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -90.03 106.48 18.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 644' ' ' THR . . . . . 0.494 HG21 HD22 ' A' ' 614' ' ' LEU . 29.8 p . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.219 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 559' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.662 0.268 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 560' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 559' ' ' ALA . 8.6 Cg_endo -86.73 -172.31 0.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.212 2.608 . . . . 0.0 112.271 -179.954 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.74 134.02 36.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.189 179.967 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 562' ' ' ALA . . . . . 0.649 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -71.17 132.45 86.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 563' ' ' PRO . . . . . 0.515 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.9 Cg_exo -47.61 162.75 0.22 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.666 2.244 . . . . 0.0 112.214 179.64 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.7 t -156.11 161.86 40.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.37 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 58.66 49.3 10.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.472 179.837 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.807 HD11 ' HG ' ' A' ' 578' ' ' LEU . 21.7 tp -75.19 158.27 33.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.376 179.479 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 567' ' ' ALA . . . . . 0.555 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.52 178.05 9.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.924 0.393 . . . . 0.0 111.448 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.12 129.51 48.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.22 179.442 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.7 p -103.34 -88.88 0.4 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.631 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.21 100.84 13.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.776 0.322 . . . . 0.0 111.33 -179.583 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 571' ' ' GLN . . . . . 0.652 ' HB2' HG13 ' A' ' 576' ' ' ILE . 4.0 tm0? -121.94 129.11 52.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 5.4 p -115.04 -161.52 0.78 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.766 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 47.5 p -91.55 11.89 22.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.745 0.307 . . . . 0.0 111.425 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 52.2 p -145.05 -43.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.14 172.46 6.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.583 179.817 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.652 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.8 tt -160.27 139.59 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.379 . . . . 0.0 111.3 179.886 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 15.1 m -108.13 131.26 54.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.807 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -114.24 157.04 23.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.652 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 p -152.28 137.12 17.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.488 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 580' ' ' TRP . . . . . 0.536 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -156.8 169.71 24.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.961 0.41 . . . . 0.0 111.371 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.9 m -81.18 135.69 35.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.136 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.02 172.45 2.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 67.8 p -83.44 9.62 10.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.38 24.68 5.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.231 179.943 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 585' ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' ' 589' ' ' VAL . 5.6 t70 -142.75 45.79 1.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -62.6 -5.55 2.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.261 -179.836 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 5.6 p -76.02 4.19 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.14 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -150.41 -19.8 0.07 OUTLIER Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.881 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 589' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 585' ' ' ASP . 6.0 t -78.93 136.7 23.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 41.4 p -106.84 -7.49 17.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.243 -179.846 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 591' ' ' GLY . . . . . 0.666 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 167.15 -179.86 40.56 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.67 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.01 128.87 39.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 593' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.7 OUTLIER -103.25 116.76 33.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.809 179.934 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 594' ' ' VAL . . . . . 0.419 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -101.99 136.7 32.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 595' ' ' TYR . . . . . 0.408 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 47.7 m-85 -99.4 168.48 9.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.135 -179.657 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -133.05 84.75 2.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.151 179.377 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 597' ' ' GLY . . . . . 0.471 ' O ' HG23 ' A' ' 598' ' ' THR . . . 89.56 -59.86 3.67 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.093 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -161.84 -16.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 179.861 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -110.35 136.75 49.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 600' ' ' LEU . . . . . 0.464 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.3 tm? -55.45 125.44 20.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.826 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -95.82 -104.87 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.372 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.0 t -90.54 165.39 13.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.271 0.558 . . . . 0.0 111.936 -179.397 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 57.8 m -129.92 128.36 42.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.003 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 604' ' ' VAL . . . . . 0.722 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.7 m -127.8 -177.93 2.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.839 0.352 . . . . 0.0 111.713 -179.364 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 605' ' ' THR . . . . . 0.666 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 72.1 p -137.87 2.04 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.878 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -117.09 -123.11 3.38 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.424 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 2.0 p -130.6 8.78 4.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.681 0.277 . . . . 0.0 111.165 179.987 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 608' ' ' THR . . . . . 0.556 ' O ' HG11 ' A' ' 604' ' ' VAL . 40.6 p -130.19 126.18 36.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.266 -179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 609' ' ' ALA . . . . . 0.722 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -114.51 126.1 54.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.247 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 610' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.6 m -111.8 123.67 50.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 611' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -106.56 138.68 30.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.086 -179.982 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.02 163.46 15.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.823 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 67.97 68.43 1.65 Allowed Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.436 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 614' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.0 OUTLIER -123.05 152.5 40.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -97.53 155.07 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.996 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.52 161.89 15.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 55.54 38.91 30.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.008 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.13 141.45 36.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.114 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 89.9 p -87.7 131.26 34.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.721 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.366 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -106.42 118.56 36.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.29 179.249 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -111.34 165.11 12.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.21 0.529 . . . . 0.0 112.004 -179.151 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.91 136.53 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.888 179.514 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 624' ' ' VAL . . . . . 0.517 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.58 151.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 111.755 -179.297 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 625' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.7 mttt -139.81 157.65 45.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.704 -179.725 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -109.22 145.2 36.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.201 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 131.36 26.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.764 179.845 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.46 169.81 8.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.981 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.57 37.01 0.85 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.022 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -134.98 18.51 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.967 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 68.34 32.21 75.4 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.588 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 632' ' ' ASN . . . . . 0.58 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 18.7 m120 -127.57 125.12 39.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.713 0.292 . . . . 0.0 110.915 -179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -119.77 134.93 61.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.885 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 60.2 p -71.56 -170.51 0.54 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.121 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 635' ' ' ALA . . . . . 0.649 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.7 173.72 8.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.596 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 636' ' ' ALA . . . . . 0.488 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.64 134.43 34.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.971 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.3 t -73.06 -172.21 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.15 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 149.38 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -84.24 128.0 34.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 12.2 p -103.23 135.87 38.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -106.99 120.1 41.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.93 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.631 HG21 ' HG3' ' A' ' 571' ' ' GLN . 0.7 OUTLIER -122.92 127.27 74.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.95 179.957 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -96.68 103.52 15.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.184 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.892 0.377 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.26 -61.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.995 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -58.02 142.67 79.46 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.214 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 589' ' ' VAL . 60.7 Cg_endo -72.49 -177.55 2.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.538 2.159 . . . . 0.0 112.436 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 69.5 p -91.98 155.78 17.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.105 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.735 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -83.08 127.03 70.86 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.447 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.3 Cg_exo -48.34 138.42 23.55 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.542 2.161 . . . . 0.0 111.683 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 52.5 p -128.28 162.47 26.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.524 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 59.38 54.38 4.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.598 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' ' 578' ' ' LEU . 65.5 tp -69.68 160.78 30.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.417 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.88 176.05 11.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.996 0.426 . . . . 0.0 111.581 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 70.8 p -136.52 122.81 20.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.461 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 7.0 p -99.42 -88.04 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.19 131.5 34.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.075 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.463 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -150.49 113.65 4.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.825 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.8 p -95.84 -153.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.99 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.2 p -97.62 22.41 9.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.9 p -166.15 -46.51 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.502 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.34 133.59 50.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.213 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 21.5 tt -124.33 153.17 30.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.043 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.7 m -122.95 121.68 36.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -105.72 149.47 26.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.452 -179.307 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 579' ' ' SER . . . . . 0.461 ' O ' HD12 ' A' ' 566' ' ' LEU . 0.3 OUTLIER -137.83 143.83 41.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.112 179.655 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.571 ' CE2' HG11 ' A' ' 624' ' ' VAL . 47.6 p90 -158.55 169.98 23.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.924 0.392 . . . . 0.0 111.483 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.93 128.88 33.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.26 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.99 155.09 32.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.05 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 16.4 m -65.07 142.34 58.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.91 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 6.8 m -64.44 -17.49 63.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.047 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -112.75 143.57 43.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.957 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -152.33 42.55 0.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -17.47 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.186 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -152.32 -4.0 0.16 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.551 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 560' ' ' PRO . 12.1 t -64.57 149.44 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.755 0.312 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 39.7 p -124.3 -51.5 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.515 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -153.86 -171.91 21.4 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.904 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -121.52 175.7 6.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.855 0.36 . . . . 0.0 110.975 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.49 ' HB3' HD21 ' A' ' 600' ' ' LEU . 3.6 m-20 -140.21 131.92 27.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.677 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.585 ' HB ' HG22 ' A' ' 602' ' ' THR . 43.1 t -99.9 126.23 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.205 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.429 ' HB2' ' OG1' ' A' ' 623' ' ' THR . 41.3 m-85 -99.97 129.47 46.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -106.55 84.77 2.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.542 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.91 -86.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.341 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -143.63 11.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.912 0.387 . . . . 0.0 111.054 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -137.0 151.1 48.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.09 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -60.32 136.02 57.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.417 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -113.06 -101.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.497 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.585 HG22 ' HB ' ' A' ' 594' ' ' VAL . 12.2 t -88.85 176.93 6.84 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.789 0.328 . . . . 0.0 111.425 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -140.58 140.03 35.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.931 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.805 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.9 m -140.39 177.48 4.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.496 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.515 HG22 ' HA3' ' A' ' 591' ' ' GLY . 1.4 p -144.57 3.26 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.018 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.63 -132.02 6.1 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 4.71 13.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.689 0.28 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.411 ' O ' HG11 ' A' ' 604' ' ' VAL . 36.8 p -129.89 -178.98 4.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.805 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -153.78 147.8 25.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.996 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.3 m -127.76 122.43 32.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.506 HD11 HG11 ' A' ' 594' ' ' VAL . 3.5 mt -121.68 118.11 54.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.976 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -102.84 175.24 5.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.866 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.58 70.76 0.99 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.498 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.513 HD12 ' O ' ' A' ' 574' ' ' SER . 8.5 mt -136.93 122.46 19.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.762 0.315 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -73.37 143.92 46.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.29 161.4 29.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.384 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.73 44.31 26.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.283 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.1 m -140.12 152.43 46.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.321 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.2 t -89.24 134.03 34.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -137.78 122.82 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.257 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 64.0 p -103.1 124.22 48.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -119.21 162.38 18.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.104 0.478 . . . . 0.0 111.732 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.448 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 0.8 OUTLIER -155.35 179.49 9.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.258 179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.571 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -138.54 147.26 25.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.004 0.43 . . . . 0.0 111.596 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.498 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 3.2 mmtp -141.02 120.21 12.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.38 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -80.13 138.45 36.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.634 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.455 ' HG2' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -124.77 161.93 25.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.881 0.372 . . . . 0.0 111.312 -179.725 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER -123.7 155.31 38.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.661 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.34 51.66 2.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.189 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.13 3.22 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.172 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 92.28 42.87 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.55 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.45 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . 18.5 m-80 -134.28 119.47 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.788 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.37 148.3 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 0.0 111.34 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 13.3 p -90.25 -165.94 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.735 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.29 176.18 6.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.714 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.498 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -89.96 146.76 24.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.044 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 6.6 p -81.15 -174.02 4.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.884 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.17 146.64 54.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.555 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 123.17 27.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.9 m -100.79 106.88 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.98 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.55 95.03 8.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.955 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.38 136.36 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.081 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.33 114.54 28.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.79 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.201 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.91 0.386 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.69 69.43 10.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -64.64 152.57 89.54 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.76 -159.86 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.668 2.245 . . . . 0.0 112.467 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 138.94 50.41 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.104 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.98 132.3 86.73 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.23 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.452 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.2 Cg_exo -45.75 155.91 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.77 2.313 . . . . 0.0 112.116 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 70.2 p -136.52 149.96 48.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.997 0.427 . . . . 0.0 111.742 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 59.36 65.01 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.004 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' A' ' 578' ' ' LEU . 1.1 tp -88.48 152.64 21.75 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.646 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -178.77 6.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.952 0.406 . . . . 0.0 111.341 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.36 127.38 39.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.309 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.82 -86.16 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.326 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.46 97.94 10.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.534 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -117.54 109.83 17.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 53.6 p -90.32 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 34.4 p -89.76 5.52 45.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.412 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 614' ' ' LEU . 20.2 p -140.35 -48.1 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -106.91 165.05 11.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.74 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 571' ' ' GLN . 20.3 tt -150.55 146.23 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.359 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 85.0 m -109.17 123.65 49.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.675 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -111.43 131.24 55.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.7 t -127.05 137.55 53.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.382 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.457 ' CE2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -154.52 169.74 23.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.143 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.1 m -88.01 129.43 35.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.994 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.74 165.09 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.9 166.57 13.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.033 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -1.4 53.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.836 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -117.95 64.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.418 ' O ' ' HB ' ' A' ' 587' ' ' VAL . 34.4 t30 -70.9 -153.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.611 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 586' ' ' ASN . 47.3 t 74.98 -37.74 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -108.98 -28.09 4.59 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.854 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.416 HG22 ' OD1' ' A' ' 628' ' ' ASP . 21.8 t -68.87 124.26 24.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.607 0.241 . . . . 0.0 110.585 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 18.4 p -123.38 1.15 8.99 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.755 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.18 168.72 40.67 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.193 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -131.08 162.21 30.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.787 0.327 . . . . 0.0 110.602 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.48 ' OD1' HG23 ' A' ' 603' ' ' THR . 48.2 m-20 -126.83 135.44 51.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.868 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.406 HG11 HD11 ' A' ' 611' ' ' ILE . 47.2 t -100.15 129.07 51.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.25 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.431 ' CE2' ' HG3' ' A' ' 625' ' ' LYS . 33.7 m-85 -107.29 129.63 54.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.723 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -123.91 94.23 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 60.11 72.05 0.68 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.507 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 8.2 p 46.12 34.48 2.11 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.907 0.384 . . . . 0.0 111.356 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.51 107.9 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.759 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 3.9 tt -52.36 122.83 9.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.078 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -91.81 -95.27 0.13 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.247 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 7.6 t -90.73 177.01 6.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.104 0.478 . . . . 0.0 111.79 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 603' ' ' THR . . . . . 0.48 HG23 ' OD1' ' A' ' 593' ' ' ASP . 7.5 m -140.61 134.17 30.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.545 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.778 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.4 m -136.67 -173.45 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.956 0.408 . . . . 0.0 111.589 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.755 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.6 p -131.81 -25.32 2.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.999 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -92.98 -151.19 27.64 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.484 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 17.7 p -100.41 12.94 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.843 0.354 . . . . 0.0 111.209 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.91 155.43 45.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.988 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.778 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.79 155.18 43.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.67 113.99 11.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.525 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -99.78 113.84 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.671 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 13.3 p -101.94 132.26 47.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.913 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.48 1.34 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.491 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 574' ' ' SER . 6.7 mt -137.0 114.35 10.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.768 0.318 . . . . 0.0 110.693 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -67.33 128.49 36.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -64.1 175.14 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.271 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 25.7 t70 57.09 30.39 18.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.07 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.4 m -140.18 144.74 36.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.45 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 619' ' ' SER . . . . . 0.41 ' HA ' ' HB3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -87.87 134.45 33.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.396 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -127.8 139.32 52.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 111.443 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.1 p -117.96 117.9 30.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.11 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 576' ' ' ILE . 68.2 m-85 -106.68 171.31 7.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.328 0.585 . . . . 0.0 112.164 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.91 173.67 8.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.102 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.552 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -139.68 150.14 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.981 0.419 . . . . 0.0 111.448 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 634' ' ' SER . 7.6 mttt -140.54 123.46 16.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.203 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.03 134.85 35.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.308 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -131.63 149.9 52.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.831 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.416 ' OD1' HG22 ' A' ' 589' ' ' VAL . 1.8 m-20 -111.73 -179.6 3.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.12 43.07 1.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.041 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.52 5.27 0.61 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.208 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 86.95 9.27 74.36 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.462 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.7 m-80 -93.43 116.95 29.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.9 p -125.06 135.38 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.56 -160.34 0.15 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.993 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.48 -177.08 4.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.045 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -89.93 136.77 32.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.552 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -72.15 -174.27 1.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.778 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.31 142.64 42.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -88.13 126.19 34.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.097 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.443 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 10.2 p -101.02 124.86 54.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 3.4 p -95.96 89.85 5.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.867 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.56 132.27 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 619' ' ' SER . 0.4 OUTLIER -112.61 133.66 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 111.126 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.088 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 53.9 m80 . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.75 0.309 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.27 -13.4 16.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.007 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -68.37 146.93 98.15 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.198 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.425 ' HB2' ' H ' ' A' ' 561' ' ' THR . 83.7 Cg_endo -79.11 -139.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.721 2.281 . . . . 0.0 112.456 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.487 HG21 ' OG1' ' A' ' 584' ' ' THR . 0.2 OUTLIER -114.22 134.78 54.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.864 0.364 . . . . 0.0 111.048 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.678 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -78.46 130.11 72.47 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.455 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 52.0 Cg_exo -54.23 171.57 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.68 2.253 . . . . 0.0 112.042 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.8 t -163.6 164.25 24.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.28 34.62 24.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.3 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.804 HD11 ' HG ' ' A' ' 578' ' ' LEU . 35.8 tp -60.92 158.83 12.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.467 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.63 -177.54 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.263 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.3 t -144.89 126.97 15.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.066 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 17.8 p -99.78 -81.02 0.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.545 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -83.3 104.28 13.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.584 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.17 89.85 3.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.459 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 79.5 p -80.96 -158.8 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 63.1 p -94.57 22.86 5.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.61 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.444 ' O ' HD12 ' A' ' 614' ' ' LEU . 2.9 p -168.74 -44.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.706 0.288 . . . . 0.0 111.458 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.25 138.78 41.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.67 HD11 HG11 ' A' ' 642' ' ' VAL . 9.5 tt -130.26 148.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -116.29 109.8 17.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.804 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.899 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 579' ' ' SER . . . . . 0.441 ' O ' HD12 ' A' ' 566' ' ' LEU . 34.8 t -130.82 139.97 50.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.667 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.617 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -151.84 170.07 20.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 0.0 111.255 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.5 m -79.96 135.35 36.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.057 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.51 173.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 p -76.56 155.6 33.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.852 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 584' ' ' THR . . . . . 0.487 ' OG1' HG21 ' A' ' 561' ' ' THR . 71.3 p -91.45 18.21 7.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -126.46 -69.34 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 55.11 30.81 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.031 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.52 -12.09 9.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.021 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -156.63 -4.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.428 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.8 t -62.58 133.2 28.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.7 0.286 . . . . 0.0 111.179 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.448 HG23 ' HE3' ' A' ' 627' ' ' LYS . 1.3 t -112.47 -24.05 9.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.175 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.548 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -170.96 -177.85 41.13 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.665 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -126.66 133.66 50.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.833 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.27 117.43 34.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.502 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.38 132.66 44.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.902 0.382 . . . . 0.0 111.067 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 93.1 m-85 -99.43 170.38 8.66 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.036 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -140.23 85.6 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.319 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.18 -67.38 2.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.984 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -155.5 -9.04 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.824 0.345 . . . . 0.0 110.998 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -59.12 132.96 55.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.351 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -98.65 -105.67 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.87 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.9 t -90.77 173.18 8.15 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.962 0.411 . . . . 0.0 111.497 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 4.9 m -139.09 126.97 22.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.654 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.9 m -126.45 -169.1 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.368 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.548 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 7.2 p -137.36 2.01 2.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.208 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -126.3 -147.47 6.85 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.424 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 81.5 p -105.12 25.92 9.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.347 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.6 OUTLIER -146.5 127.31 14.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.096 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.846 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.93 140.36 51.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.157 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -116.85 115.05 24.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.9 mt -114.12 110.46 32.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.189 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 612' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 574' ' ' SER . 0.5 OUTLIER -112.5 158.52 19.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.769 179.787 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.48 29.59 9.3 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.617 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.444 HD12 ' O ' ' A' ' 574' ' ' SER . 6.0 mt -91.4 -173.91 3.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.764 0.316 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -123.18 120.31 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.06 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -57.9 159.78 5.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.94 37.39 28.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.165 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.4 m -140.13 146.54 38.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.255 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 28.1 t -89.47 139.34 30.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.638 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -140.15 125.35 18.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 111.254 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.44 123.87 46.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.519 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.413 ' HB2' HG23 ' A' ' 640' ' ' VAL . 67.6 m-85 -115.66 169.08 9.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.244 0.545 . . . . 0.0 111.829 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -159.28 159.62 34.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.59 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.759 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -121.12 148.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.132 0.491 . . . . 0.0 111.948 -179.508 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 634' ' ' SER . 8.3 mttt -140.35 157.89 44.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.688 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.68 141.24 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.413 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.448 ' HE3' HG23 ' A' ' 590' ' ' THR . 0.0 OUTLIER -131.16 153.71 49.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.784 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.51 174.78 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.942 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.65 56.3 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.85 -42.31 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.178 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.79 2.95 1.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.472 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -86.81 144.89 26.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 110.849 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 9.8 m -136.03 148.89 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.366 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.429 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.6 OUTLIER -87.18 -161.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.788 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.678 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.06 169.46 11.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 111.012 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.97 140.25 30.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.428 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -78.84 -173.5 3.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -60.28 155.07 18.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.902 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.83 154.08 27.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.096 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 622' ' ' PHE . 2.9 m -136.93 109.12 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.52 111.16 22.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.706 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.67 HG11 HD11 ' A' ' 576' ' ' ILE . 0.9 OUTLIER -112.55 152.41 14.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.989 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -113.98 106.5 14.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.021 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.776 0.322 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 5.7 mmm -100.04 -80.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -74.3 145.18 82.53 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.559 ' HG2' ' HB2' ' A' ' 634' ' ' SER . 74.4 Cg_endo -73.52 -148.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.493 HG23 ' HB2' ' A' ' 583' ' ' SER . 0.1 OUTLIER -119.0 128.25 54.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.934 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.13 128.73 91.34 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.246 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 80.3 Cg_exo -45.16 145.67 3.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.698 2.266 . . . . 0.0 112.086 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 32.8 p -127.82 156.16 42.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.37 . . . . 0.0 111.685 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.08 60.75 3.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.71 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.585 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 13.0 tp -79.29 158.29 27.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.585 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.69 175.07 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 0.0 111.673 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 578' ' ' LEU . 13.7 p -127.03 128.94 47.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.5 p -99.57 -84.55 0.41 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.359 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.36 148.89 25.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.368 . . . . 0.0 111.167 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 136.78 8.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.732 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.421 ' HB ' ' H ' ' A' ' 573' ' ' THR . 31.9 p -134.22 -155.3 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.12 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.743 HG22 ' HB2' ' A' ' 616' ' ' ALA . 0.0 OUTLIER -95.28 20.73 8.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.301 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 12.9 p -167.06 -41.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.51 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -109.75 155.85 21.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.275 -179.45 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.453 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 15.0 tt -159.26 134.98 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 111.242 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 55.6 m -104.46 141.7 35.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.962 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 608' ' ' THR . 54.6 mt -123.7 146.06 48.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 51.9 p -133.39 127.16 32.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.733 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.503 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.8 p90 -137.21 169.6 17.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.172 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.7 m -87.12 138.09 31.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.129 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.76 166.5 2.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.222 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.493 ' HB2' HG23 ' A' ' 561' ' ' THR . 34.9 p -73.61 -3.67 29.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.928 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 59.34 16.29 4.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.077 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -148.27 68.18 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.592 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -82.0 25.24 0.58 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.196 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.01 -19.27 21.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.985 0.422 . . . . 0.0 110.661 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -149.69 -14.81 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.242 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 17.3 t -66.02 144.29 14.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.778 0.323 . . . . 0.0 111.065 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 75.4 p -123.74 -48.7 1.9 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.281 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.593 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -140.44 -174.68 14.04 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.787 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -133.81 154.84 50.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.683 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -121.73 137.71 54.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.952 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.426 HG11 HD11 ' A' ' 611' ' ' ILE . 56.1 t -104.19 128.42 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.755 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.54 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 40.7 m-85 -102.2 126.84 49.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.305 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 7.7 p-10 -99.02 84.32 3.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.225 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 82.84 -72.53 2.82 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.226 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 17.2 p -147.45 3.41 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.663 0.268 . . . . 0.0 111.265 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -121.75 173.96 7.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.453 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -90.3 119.15 30.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.638 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -92.83 -104.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.364 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 15.1 t -90.64 173.49 8.02 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 111.616 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 3.1 m -139.52 119.76 13.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 609' ' ' ALA . 12.7 m -122.41 -172.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.506 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.593 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 27.7 p -141.6 -10.04 0.93 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.098 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -102.07 -123.8 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.61 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 26.3 p -122.12 -13.12 8.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.713 0.292 . . . . 0.0 111.245 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.439 ' O ' HG11 ' A' ' 604' ' ' VAL . 27.3 p -105.58 172.74 6.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.081 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.74 155.14 36.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.187 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -129.95 117.17 19.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.209 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 575' ' ' SER . 5.7 mt -115.84 109.82 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.013 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.8 m -107.66 155.37 20.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.839 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 90.65 54.52 2.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.538 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.9 mt -118.82 144.16 46.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.88 0.372 . . . . 0.0 110.937 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -94.91 137.91 33.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.028 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 616' ' ' ALA . . . . . 0.743 ' HB2' HG22 ' A' ' 573' ' ' THR . . . -68.11 162.08 25.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.422 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 55.51 43.3 28.74 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.307 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 618' ' ' THR . . . . . 0.443 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 5.6 m -140.65 146.56 38.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.34 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.6 t -91.16 120.38 32.05 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.527 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 620' ' ' TYR . . . . . 0.443 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 74.8 m-85 -121.63 129.32 52.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.957 0.408 . . . . 0.0 111.524 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 64.0 p -104.33 141.02 37.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.92 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.655 ' H ' HG12 ' A' ' 640' ' ' VAL . 32.1 m-85 -129.31 169.05 15.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.274 0.559 . . . . 0.0 112.09 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.85 168.18 16.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.057 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.535 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -137.8 153.45 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.065 0.46 . . . . 0.0 111.56 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.54 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 1.4 mttp -140.41 149.95 43.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.92 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -105.18 136.92 43.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.505 ' HB3' HG22 ' A' ' 633' ' ' VAL . 0.3 OUTLIER -127.88 149.77 50.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.116 -179.661 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.464 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 1.8 m-20 -107.14 167.36 9.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.651 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.25 -8.92 58.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.149 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -92.56 -9.99 39.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 97.27 54.28 1.28 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.71 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -137.93 131.68 31.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.779 0.323 . . . . 0.0 110.975 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 627' ' ' LYS . 24.9 t -126.32 132.79 70.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.253 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.559 ' HB2' ' HG2' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -79.28 -157.48 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 179.656 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -89.34 177.23 6.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.872 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -86.26 143.51 27.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.46 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -73.24 -170.13 0.73 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.35 146.87 42.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.632 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.06 134.33 36.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.219 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.655 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -99.78 154.43 4.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.935 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.03 81.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.04 132.31 45.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.898 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -105.54 111.92 24.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.244 179.976 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 25.8 p80 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.827 0.346 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -107.13 -156.37 0.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.865 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -55.36 155.15 10.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.148 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.44 ' HG2' ' HB3' ' A' ' 634' ' ' SER . 40.2 Cg_endo -65.95 173.97 6.37 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.481 2.121 . . . . 0.0 112.236 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 1.4 p -84.97 127.43 34.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.049 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.72 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.86 127.28 91.45 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.042 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.418 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.3 Cg_exo -46.18 133.61 15.22 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.657 2.238 . . . . 0.0 112.039 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 27.7 p -117.15 153.4 32.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.658 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 58.95 77.35 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.773 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' ' 578' ' ' LEU . 24.6 tp -83.7 162.4 20.73 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.563 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -159.22 167.31 29.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.0 111.672 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 80.2 p -128.71 136.37 50.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.53 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -112.07 -88.13 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.504 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.96 108.69 19.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.451 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -119.91 98.9 6.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.832 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.5 p -86.63 -152.54 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.709 ' HB ' ' HB2' ' A' ' 616' ' ' ALA . 30.4 p -101.56 -10.77 19.81 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.687 0.255 . . . . 0.0 111.687 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 76.2 p -125.71 -33.86 2.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -123.44 159.43 29.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.945 0.403 . . . . 0.0 111.171 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.577 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.0 tt -142.07 151.42 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 5.5 m -118.82 127.62 53.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -121.39 137.87 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.332 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 37.5 t -128.6 146.76 50.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.282 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.455 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 48.1 p90 -157.79 170.07 23.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.924 0.392 . . . . 0.0 111.323 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.74 125.51 29.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.233 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.34 153.14 35.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.347 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -70.72 169.72 13.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.22 -19.19 20.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.959 0.409 . . . . 0.0 111.114 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.601 ' O ' HG23 ' A' ' 589' ' ' VAL . 3.0 t0 -89.03 37.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.767 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -58.46 -13.31 5.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.2 3.45 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.059 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -143.65 -24.73 0.16 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 585' ' ' ASP . 10.2 t -61.24 144.98 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 111.066 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 16.6 p -124.69 -9.96 7.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.286 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.624 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.03 172.45 36.54 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.513 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -124.65 134.12 53.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 111.16 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -100.94 135.84 41.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.451 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.556 HG11 HD11 ' A' ' 611' ' ' ILE . 97.8 t -101.75 135.13 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.6 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 57.0 m-85 -112.6 129.5 56.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.647 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -122.06 107.85 12.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 57.88 59.59 10.55 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.291 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.1 p 52.64 33.24 13.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.949 0.404 . . . . 0.0 111.327 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.81 111.6 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -47.81 153.67 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.623 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -134.93 -86.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.307 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.6 t -90.5 171.24 9.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.191 0.52 . . . . 0.0 111.85 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 46.5 m -140.36 123.53 16.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.494 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.772 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.0 m -128.27 -169.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.926 0.393 . . . . 0.0 111.549 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.624 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.1 p -142.0 -31.55 0.54 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.964 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -76.26 -125.22 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.435 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 16.7 p -122.84 -13.09 7.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.734 0.302 . . . . 0.0 111.159 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 50.0 p -108.67 155.71 20.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.021 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.772 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.35 145.28 38.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.071 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.4 m -127.01 119.76 27.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.2 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.577 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.6 mp -104.75 139.51 25.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.936 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.83 163.74 16.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 80.6 39.27 14.78 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.509 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -96.55 162.76 13.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 110.996 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -125.46 127.03 45.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.913 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 616' ' ' ALA . . . . . 0.709 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -59.31 160.12 6.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.447 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.83 43.66 30.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.207 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.7 m -140.42 146.46 38.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.396 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 6.0 t -86.92 137.54 32.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.472 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -140.12 131.14 26.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.015 0.436 . . . . 0.0 112.113 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -106.31 130.33 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.482 178.647 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -123.17 166.96 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.375 0.607 . . . . 0.0 112.548 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.09 160.48 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.822 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.453 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -128.25 150.95 34.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.098 0.475 . . . . 0.0 111.574 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.527 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.9 mmtt -140.18 149.73 43.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.872 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.63 150.42 29.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.747 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 141.81 39.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.752 0.311 . . . . 0.0 111.208 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -108.04 165.23 11.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.29 9.98 21.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -96.19 -0.04 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.075 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 90.22 27.77 19.68 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.489 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -128.1 159.68 34.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.721 0.296 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.53 145.97 26.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HG2' ' A' ' 560' ' ' PRO . 51.4 p -82.71 -174.81 5.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.72 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.28 178.69 6.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.995 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.527 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -88.0 142.95 27.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.453 ' HB3' HG23 ' A' ' 624' ' ' VAL . 2.4 p -77.2 -166.8 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.216 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.02 140.35 45.37 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.787 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.72 119.52 22.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.814 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 621' ' ' THR . 8.7 p -99.88 138.36 24.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.165 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.9 t -107.13 89.15 2.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.699 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.438 HG21 HD11 ' A' ' 576' ' ' ILE . 3.7 m -110.02 141.15 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.595 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -95.97 163.17 13.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.653 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 644' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 616' ' ' ALA . 4.9 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.224 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 65.7 m80 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.859 0.361 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 558' ' ' MET . . . . . 0.402 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 4.0 mtt -123.57 -64.35 1.16 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.815 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -65.53 137.45 96.49 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.06 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.455 ' HB2' ' H ' ' A' ' 561' ' ' THR . 90.4 Cg_endo -76.94 -149.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.593 2.196 . . . . 0.0 112.256 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.522 HG21 HG23 ' A' ' 584' ' ' THR . 0.2 OUTLIER -113.97 114.49 26.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.046 179.786 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.44 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -60.58 128.89 88.99 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.983 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.24 151.77 4.14 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.492 2.128 . . . . 0.0 111.899 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.55 156.09 45.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 59.09 45.53 14.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.725 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 580' ' ' TRP . 48.8 tp -66.71 156.7 34.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.439 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.11 168.87 21.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.414 ' HA ' HD23 ' A' ' 578' ' ' LEU . 59.9 p -124.04 143.93 50.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.156 179.217 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 14.9 p -125.05 -86.35 0.63 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.578 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.79 98.89 8.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 111.194 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -118.28 102.4 8.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.86 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 15.1 p -87.87 -152.02 0.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.842 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.3 p -100.83 -22.65 14.78 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.672 0.272 . . . . 0.0 111.627 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.0 p -122.22 -7.63 8.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.318 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.19 165.18 27.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.898 0.38 . . . . 0.0 111.038 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.424 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 18.6 tt -156.32 144.52 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.011 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.9 m -120.74 127.6 52.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 568' ' ' SER . 45.2 mt -119.75 136.16 54.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.8 t -126.29 139.06 53.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.316 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.55 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -150.62 169.69 20.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.852 0.358 . . . . 0.0 111.378 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 16.6 m -79.93 131.31 35.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.154 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.23 178.67 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.427 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.8 OUTLIER -84.63 169.87 13.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 584' ' ' THR . . . . . 0.522 HG23 HG21 ' A' ' 561' ' ' THR . 1.4 p -99.2 -15.54 18.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.722 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.454 ' O ' HG23 ' A' ' 589' ' ' VAL . 0.8 OUTLIER -118.04 61.28 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.017 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -73.83 1.53 10.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.005 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.75 -12.47 12.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.325 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -133.98 -18.92 0.93 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.594 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 585' ' ' ASP . 5.3 t -72.79 147.51 9.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.851 0.358 . . . . 0.0 111.105 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.5 p -117.91 -49.65 2.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.197 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.562 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -150.1 171.78 30.03 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.783 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -118.61 133.42 55.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.739 0.304 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.769 ' HB3' HD21 ' A' ' 600' ' ' LEU . 0.5 OUTLIER -111.35 120.5 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.943 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.37 138.36 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.811 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.493 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 95.7 m-85 -99.97 154.88 18.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.556 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.449 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 13.6 t30 -128.2 84.59 2.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.256 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 97.13 -71.06 0.75 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.426 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.26 4.36 0.14 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 111.378 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -128.2 172.09 11.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.769 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.0 OUTLIER -79.97 119.8 23.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.8 179.783 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.449 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -90.56 -105.47 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.011 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.4 t -90.5 162.27 15.12 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 111.238 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -127.69 128.83 46.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.635 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.0 m -134.45 -176.35 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.375 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.562 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 73.1 p -140.88 -15.42 0.9 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -91.46 -121.29 2.59 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.621 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.7 p -127.99 -4.41 5.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.831 0.348 . . . . 0.0 111.317 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.468 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -113.9 168.86 9.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.136 179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.635 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -154.27 119.4 5.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.915 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.5 m -107.33 120.21 41.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.409 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.424 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.3 mp -109.42 131.04 61.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.749 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 87.4 p -111.98 172.09 7.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 62.5 80.58 0.11 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.469 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.1 mt -137.87 179.58 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.856 0.36 . . . . 0.0 110.959 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -124.94 155.23 39.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.905 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 161.84 15.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.317 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 6.2 t70 55.68 43.4 28.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.059 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.37 139.05 35.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.333 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.2 t -86.05 131.24 34.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -129.34 137.39 50.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.282 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.13 119.44 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.379 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.409 ' HB2' HG23 ' A' ' 640' ' ' VAL . 71.7 m-85 -113.55 159.87 19.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 111.901 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.73 137.69 11.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.217 -0.902 . . . . 0.0 109.792 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.55 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -99.94 149.05 6.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.024 0.44 . . . . 0.0 111.569 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -136.79 152.94 50.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.04 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.45 137.63 50.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.236 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.44 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.437 ' OD1' HG22 ' A' ' 589' ' ' VAL . 4.2 m-20 -108.78 170.08 8.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.61 11.04 16.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.999 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -105.51 -13.52 15.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 98.88 41.34 3.11 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.547 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.402 ' ND2' ' HB3' ' A' ' 558' ' ' MET . 22.0 m120 -135.93 130.4 33.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.5 t -124.7 131.09 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -77.09 175.21 9.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.929 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -65.26 168.05 7.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.265 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.51 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -79.53 140.15 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.438 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.2 t -67.66 -179.49 1.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.013 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -65.57 153.75 40.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.667 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.51 142.35 31.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.299 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.409 HG23 ' HB2' ' A' ' 622' ' ' PHE . 3.7 m -129.91 114.33 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.74 123.52 34.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.34 119.48 55.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.181 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -92.01 101.34 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.194 -0.907 . . . . 0.0 111.104 -179.872 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.771 0.32 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 81.7 mtp -83.83 -17.05 42.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.921 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -62.55 154.54 72.87 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.17 -152.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.533 2.155 . . . . 0.0 112.445 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 583' ' ' SER . 5.7 m -111.53 131.31 55.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.012 0.434 . . . . 0.0 111.396 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.62 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.58 130.68 88.04 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.383 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.556 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -45.69 146.13 3.94 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.74 2.293 . . . . 0.0 111.819 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.3 p -119.95 137.13 54.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.992 0.425 . . . . 0.0 112.005 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 54.79 94.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.035 179.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.829 HD11 ' HG ' ' A' ' 578' ' ' LEU . 54.6 tp -89.8 160.36 16.55 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.524 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.75 178.74 9.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.422 . . . . 0.0 111.684 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.37 149.4 36.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.421 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 5.4 p -124.83 -84.82 0.64 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.602 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.48 112.5 20.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.433 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.57 ' HB2' HG13 ' A' ' 576' ' ' ILE . 5.8 tt0 -134.9 114.02 12.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.904 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 23.8 p -104.07 -165.78 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.82 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -91.17 29.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 11.3 p -162.33 -39.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.021 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.19 171.77 8.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.958 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.57 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.5 tt -159.48 151.19 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.419 . . . . 0.0 111.164 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.3 m -119.43 133.69 55.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.793 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.829 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -121.79 131.39 54.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.027 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.83 127.96 46.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.525 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.453 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -137.29 170.05 16.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.5 m -84.79 134.59 34.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.028 0.442 . . . . 0.0 111.344 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.55 168.63 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.009 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.746 ' HB3' ' HB ' ' A' ' 561' ' ' THR . 1.2 m -79.75 162.52 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.795 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.72 -7.15 58.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.793 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.508 ' O ' HG23 ' A' ' 589' ' ' VAL . 41.1 m-20 -125.16 64.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.823 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.06 0.92 16.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.71 -9.54 13.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.105 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -130.86 -21.22 1.12 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.405 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 585' ' ' ASP . 22.9 t -70.43 141.81 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.1 t -126.14 -11.43 6.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.111 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.602 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -178.03 -177.57 46.88 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.715 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -134.02 157.94 44.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.935 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -120.41 129.66 54.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.463 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.563 HG22 HG13 ' A' ' 624' ' ' VAL . 56.8 t -99.61 140.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.231 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 92.0 m-85 -123.64 147.93 46.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 621' ' ' THR . 25.1 t30 -137.95 88.91 2.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 76.29 59.26 3.39 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.093 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 43.4 p 50.46 44.46 26.94 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.891 0.377 . . . . 0.0 111.261 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.04 121.0 4.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.381 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 594' ' ' VAL . 1.0 OUTLIER -54.97 130.73 42.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.872 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -112.93 -98.65 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.349 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.7 t -90.61 171.6 9.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.117 0.484 . . . . 0.0 111.821 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 2.8 m -137.58 127.8 26.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.46 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.794 HG11 ' HA ' ' A' ' 609' ' ' ALA . 15.5 m -130.59 -178.22 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.906 0.384 . . . . 0.0 111.542 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.602 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 1.4 p -133.21 -24.93 1.81 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.168 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -85.64 -126.25 1.71 Allowed Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.467 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.44 7.93 6.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.827 0.346 . . . . 0.0 111.039 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -129.2 152.83 48.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.971 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.794 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -126.9 155.7 42.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.02 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 89.0 m -134.73 109.11 8.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.997 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.45 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -110.52 116.12 51.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.002 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.71 -174.44 2.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.862 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.27 47.65 77.99 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.635 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.2 mt -117.73 173.84 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.881 0.372 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -135.76 169.87 16.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -84.62 171.11 12.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.364 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 55.7 42.42 29.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.814 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.22 143.19 42.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.285 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 619' ' ' SER . . . . . 0.47 ' HA ' ' HG3' ' A' ' 643' ' ' LYS . 0.1 OUTLIER -98.61 132.21 44.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.218 179.349 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -126.62 125.9 42.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.437 . . . . 0.0 111.911 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 596' ' ' ASN . 1.8 p -110.22 107.71 17.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.643 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.494 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 39.1 m-85 -100.15 156.33 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.523 0.677 . . . . 0.0 112.729 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -159.22 122.13 3.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.306 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.563 HG13 HG22 ' A' ' 594' ' ' VAL . 0.0 OUTLIER -99.17 157.45 3.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 0.0 111.739 -179.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 635' ' ' ALA . 0.2 OUTLIER -139.98 155.06 47.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.341 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -104.51 132.14 51.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.793 0.33 . . . . 0.0 110.945 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 632' ' ' ASN . 4.3 pttm -120.81 159.83 24.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.96 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 630' ' ' ALA . 0.4 OUTLIER -112.97 177.85 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -76.64 -19.8 57.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.648 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.468 ' H ' ' CG ' ' A' ' 628' ' ' ASP . . . -100.62 31.64 3.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.52 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 56.42 81.38 0.07 OUTLIER Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.726 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.461 ' O ' ' HA ' ' A' ' 627' ' ' LYS . 1.9 t-20 -160.38 126.64 4.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 0.0 110.716 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 6.5 m -121.89 143.91 32.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.96 0.41 . . . . 0.0 111.711 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.462 ' O ' ' HE2' ' A' ' 625' ' ' LYS . 0.9 OUTLIER -82.78 -145.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.075 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.62 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.68 177.19 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 110.998 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.51 138.15 31.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.945 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.556 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 12.8 p -67.57 -169.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.855 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -63.36 177.68 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -106.2 121.31 43.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.448 HG21 ' HG ' ' A' ' 566' ' ' LEU . 2.9 t -112.03 115.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.684 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 11.1 t -102.47 102.45 12.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.966 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.64 114.77 48.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.928 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.47 ' HG3' ' HA ' ' A' ' 619' ' ' SER . 0.0 OUTLIER -96.86 122.07 39.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.123 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.159 179.768 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.734 0.302 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.9 ptm -144.09 -81.78 0.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.96 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -63.88 141.22 97.98 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.047 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.74 -179.2 3.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.683 2.255 . . . . 0.0 112.459 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.05 136.66 34.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.408 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -64.24 129.4 94.04 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.5 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.469 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.82 140.08 10.14 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.69 2.26 . . . . 0.0 112.201 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.6 t -122.96 153.64 39.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.907 0.384 . . . . 0.0 111.727 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.94 62.55 1.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.787 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.832 HD11 ' HG ' ' A' ' 578' ' ' LEU . 55.3 tp -82.4 158.93 23.12 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.423 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.28 176.03 11.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.996 0.426 . . . . 0.0 111.786 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 20.6 p -130.24 122.62 28.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.233 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.8 p -99.83 -86.8 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.69 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.02 96.76 10.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.252 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.81 102.45 9.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 80.9 p -94.69 -155.43 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.18 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 644' ' ' THR . 4.9 p -90.16 3.36 53.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.473 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 3.4 p -152.49 -49.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.66 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.495 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -99.96 122.28 42.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.794 0.33 . . . . 0.0 111.408 -179.536 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.441 HD12 HG21 ' A' ' 642' ' ' VAL . 14.5 tt -115.49 150.22 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 18.6 m -120.27 119.33 32.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.756 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.832 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -105.85 136.41 45.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.938 -179.617 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.8 122.69 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.549 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.4 p90 -138.45 169.59 17.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.029 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 m -85.27 147.32 26.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.216 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.42 168.19 7.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.339 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -2.15 36.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.885 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 21.45 11.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.168 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -153.12 75.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -87.68 33.86 0.71 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.977 0.418 . . . . 0.0 110.829 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -85.56 -1.25 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.986 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -159.99 -25.84 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 13.6 t -59.03 146.81 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 111.258 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.7 p -120.05 -40.0 2.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.601 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -159.53 177.29 36.11 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.394 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -123.09 120.12 32.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.812 0.339 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.52 ' OD1' HG22 ' A' ' 603' ' ' THR . 4.7 m-20 -99.81 120.96 40.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.553 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.69 140.36 19.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.21 170.71 8.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.004 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.453 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 10.5 t-20 -140.26 86.35 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.608 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 83.95 -68.34 3.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.257 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.4 p -151.28 -12.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 140.79 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.922 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -55.24 149.11 13.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -114.63 -107.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.011 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 5.0 t -90.73 168.93 11.38 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.155 0.502 . . . . 0.0 111.667 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 603' ' ' THR . . . . . 0.52 HG22 ' OD1' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -132.37 121.26 23.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.543 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.849 HG11 ' HA ' ' A' ' 609' ' ' ALA . 31.5 m -125.64 -171.71 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.507 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.601 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.3 p -140.2 -12.41 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.145 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.11 -139.09 10.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.451 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 68.3 p -111.93 11.98 20.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 0.0 111.035 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -132.82 154.25 50.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.967 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.849 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.43 136.56 39.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.6 113.18 20.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.869 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.3 mt -107.26 144.09 16.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.55 -166.13 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 59.19 -108.56 1.67 Allowed Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.064 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.3 OUTLIER 56.89 104.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.958 179.109 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -70.01 111.69 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.634 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 616' ' ' ALA . . . . . 0.434 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -56.35 164.9 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.479 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 59.6 27.64 16.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.06 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.4 m -141.07 138.28 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.7 p -80.75 146.48 30.99 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.632 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -140.41 147.86 40.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.939 0.4 . . . . 0.0 111.56 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.536 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.49 120.29 39.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.06 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.468 ' CE1' HD13 ' A' ' 611' ' ' ILE . 96.9 m-85 -109.2 163.01 13.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.32 0.581 . . . . 0.0 112.213 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.09 142.92 19.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.604 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.578 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -107.94 142.5 20.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.076 0.465 . . . . 0.0 111.633 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -132.42 143.34 49.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.898 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.448 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -103.87 138.47 40.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.52 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.2 OUTLIER -128.55 137.0 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 0.0 OUTLIER -101.42 168.03 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.981 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.84 51.84 2.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.107 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -152.53 -25.43 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.21 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 116.58 28.66 2.47 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.302 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -121.9 124.63 44.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 0.0 110.682 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.52 HG12 ' HB3' ' A' ' 627' ' ' LYS . 9.4 m -120.83 135.82 59.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.375 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.448 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 10.2 p -69.85 -167.52 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.408 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.26 164.04 14.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -74.86 126.58 31.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.498 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.92 -177.12 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.624 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.11 157.67 9.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.536 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -90.35 131.17 36.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 3.1 m -114.04 109.71 29.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.049 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.6 119.77 27.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.441 HG21 HD12 ' A' ' 576' ' ' ILE . 12.1 m -123.88 160.28 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.222 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.68 112.18 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 644' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 573' ' ' THR . 62.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.168 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.3 m80 . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.785 0.326 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 57.9 21.67 7.88 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -70.9 146.69 93.43 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.914 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.56 -159.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.569 2.18 . . . . 0.0 112.276 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 583' ' ' SER . 4.5 p -112.59 123.63 50.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.11 132.22 87.37 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.699 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 78.5 Cg_exo -49.98 176.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.101 2.534 . . . . 0.0 112.413 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 5.1 t -155.66 148.92 24.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 111.605 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 56.77 68.01 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.653 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.884 HD11 ' HG ' ' A' ' 578' ' ' LEU . 49.4 tp -76.78 159.8 29.82 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.49 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.76 179.95 8.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.945 0.402 . . . . 0.0 111.567 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 82.3 p -142.67 130.21 21.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.463 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.7 p -100.6 -82.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.404 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' ALA . . . . . 0.492 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -86.12 97.08 10.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.25 97.19 7.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.6 p -84.14 -150.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.956 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 36.4 p -96.12 -45.24 6.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.73 0.3 . . . . 0.0 111.575 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 91.6 p -107.71 -3.68 18.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.625 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -139.69 163.7 31.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 111.135 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.473 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.5 tt -155.06 149.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.314 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.2 m -110.7 125.45 53.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.803 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.884 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.6 OUTLIER -108.94 149.26 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.245 -179.566 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.5 t -144.64 135.05 24.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.256 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.541 ' CD2' HG11 ' A' ' 624' ' ' VAL . 42.0 p90 -152.67 169.87 21.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.969 0.414 . . . . 0.0 111.36 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.6 110.61 16.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.781 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -51.18 151.32 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.304 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 561' ' ' THR . 0.0 OUTLIER -54.44 136.26 44.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.904 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 4.1 m -62.6 -23.63 67.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.858 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.04 46.46 1.01 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.485 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -65.04 -9.62 23.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.1 m -75.04 3.02 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.897 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -142.42 -2.9 1.06 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.427 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 627' ' ' LYS . 44.7 t -96.22 146.84 6.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.797 0.332 . . . . 0.0 110.967 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 8.1 t -111.2 -31.53 7.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.632 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -164.44 -179.9 38.84 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.878 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.41 135.52 44.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.435 ' OD1' HD11 ' A' ' 600' ' ' LEU . 0.3 OUTLIER -113.69 121.23 43.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.356 179.358 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.402 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -99.55 140.78 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.947 0.404 . . . . 0.0 111.206 -179.588 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -98.97 166.16 11.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.978 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -140.24 86.94 2.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 71.49 60.79 4.18 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.009 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.7 p 55.37 37.45 28.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.92 0.39 . . . . 0.0 111.487 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.65 112.25 2.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.435 HD11 ' OD1' ' A' ' 593' ' ' ASP . 1.1 tm? -45.88 131.17 9.58 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.353 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -113.08 -96.89 0.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.353 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.2 t -90.6 168.29 11.91 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.186 0.517 . . . . 0.0 111.985 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 18.2 m -132.5 141.6 48.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.575 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 3.5 m -140.35 -177.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.431 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.456 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 36.4 p -140.25 -13.27 1.04 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.932 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -98.1 -124.88 5.09 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.61 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.13 -14.67 8.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.3 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -101.24 176.64 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -158.78 123.57 4.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.138 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.6 m -105.42 117.27 33.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.235 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.7 mt -106.8 125.34 62.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.75 173.35 6.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.02 67.62 1.96 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.551 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 644' ' ' THR . 1.2 mp -130.59 153.5 48.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.966 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -121.45 141.45 50.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.158 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.93 174.31 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.68 28.72 14.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.2 m -139.16 141.42 38.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.99 137.38 32.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.587 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -132.62 133.19 43.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.391 . . . . 0.0 111.409 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -113.92 111.44 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.285 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -102.11 165.36 11.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.215 0.531 . . . . 0.0 111.913 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.495 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.6 OUTLIER -160.22 150.26 18.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.75 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.541 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -110.49 145.71 16.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.174 0.511 . . . . 0.0 111.777 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 1.1 mmtp -134.37 127.58 31.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.775 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.71 142.91 32.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.595 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.59 145.15 38.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -107.13 -177.51 3.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -86.23 -9.2 56.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.4 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -87.66 -6.0 58.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.129 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 91.09 23.34 30.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.4 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 2.4 m120 -108.27 148.09 30.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.686 0.279 . . . . 0.0 110.698 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.595 HG12 ' HB3' ' A' ' 627' ' ' LYS . 16.7 m -137.66 146.34 27.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.907 0.384 . . . . 0.0 111.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.85 -166.05 1.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.556 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.43 169.88 16.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.493 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.09 135.62 36.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.54 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -68.72 -175.27 0.66 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.426 -179.703 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 142.62 57.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.695 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.495 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -81.72 123.11 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 9.6 p -99.66 144.46 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.734 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.9 t -118.89 109.74 16.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.87 134.2 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.34 115.93 28.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.723 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 644' ' ' THR . . . . . 0.544 HG21 HD23 ' A' ' 614' ' ' LEU . 21.9 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.005 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.739 0.304 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 3.6 mtm 59.41 20.53 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -79.51 152.72 75.82 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.99 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.45 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.428 2.085 . . . . 0.0 112.25 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.439 HG21 ' H ' ' A' ' 584' ' ' THR . 0.1 OUTLIER -103.77 130.41 51.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.968 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.27 126.9 92.51 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.456 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.6 Cg_exo -47.5 148.15 5.69 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.556 2.171 . . . . 0.0 112.094 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 30.6 p -138.58 161.11 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 111.387 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.1 51.85 8.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.609 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.906 HD11 ' HG ' ' A' ' 578' ' ' LEU . 11.5 tp -73.89 158.61 34.15 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.583 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -177.64 6.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 111.531 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 86.8 p -138.97 125.72 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.368 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.1 p -99.8 -86.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.509 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.19 102.78 15.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.195 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.492 ' HB2' HG13 ' A' ' 576' ' ' ILE . 1.9 tm0? -121.25 116.86 25.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.957 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.5 p -98.56 -159.15 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.195 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.75 2.43 54.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.536 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.47 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.3 p -142.39 -47.99 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.803 0.335 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 1.0 OUTLIER -100.08 166.37 11.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.82 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.492 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.3 tt -154.91 142.58 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 7.0 m -109.21 113.55 26.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.78 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.906 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.0 OUTLIER -102.86 134.06 46.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.203 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 t -128.64 133.97 48.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.54 ' CE2' HG11 ' A' ' 624' ' ' VAL . 42.9 p90 -146.94 169.76 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.171 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -79.98 132.4 36.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.262 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.15 159.8 28.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.094 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.2 p -74.78 158.73 32.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.79 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 584' ' ' THR . . . . . 0.439 ' H ' HG21 ' A' ' 561' ' ' THR . 0.1 OUTLIER -69.86 -17.87 63.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.265 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -103.42 161.73 13.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -160.96 -10.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -6.34 8.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.746 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.33 -35.44 0.37 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.506 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 589' ' ' VAL . 4.7 t -59.07 148.45 6.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.5 -19.27 2.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.369 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.73 173.42 46.05 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.806 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -127.84 130.4 48.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.683 0.278 . . . . 0.0 110.836 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.84 126.26 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.614 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.443 HG21 HD11 ' A' ' 611' ' ' ILE . 0.2 OUTLIER -100.48 137.19 28.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.01 0.433 . . . . 0.0 111.625 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.753 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 98.0 m-85 -102.36 157.61 16.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.87 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -140.4 100.19 3.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.625 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 58.18 68.56 1.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.202 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.2 p 48.12 33.26 3.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.424 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.47 105.7 1.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.768 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.753 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.5 OUTLIER -47.92 137.7 9.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.386 -179.61 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.28 -98.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.9 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 4.0 t -90.64 168.39 11.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.185 0.517 . . . . 0.0 111.741 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 5.1 m -133.19 134.58 44.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.302 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.9 m -134.54 -179.75 3.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.496 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.554 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 40.5 p -132.29 -5.94 3.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.31 -131.04 6.9 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.471 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.09 4.69 10.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 111.063 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.469 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -128.63 140.1 51.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.9 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.829 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.79 157.77 27.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.164 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.75 102.46 5.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.962 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.462 HD13 ' CE1' ' A' ' 622' ' ' PHE . 4.2 mt -99.64 121.03 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.98 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.8 t -110.91 174.75 5.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.45 62.28 4.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.466 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 574' ' ' SER . 7.9 mt -130.74 143.14 50.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.866 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.24 142.92 35.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.043 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -76.99 159.22 30.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.285 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 11.5 t0 55.48 49.68 16.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.065 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.3 m -139.96 144.55 37.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 619' ' ' SER . . . . . 0.528 ' HA ' ' HG2' ' A' ' 643' ' ' LYS . 13.6 t -85.12 112.77 20.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.518 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.3 m-85 -115.83 134.54 54.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.954 0.406 . . . . 0.0 111.607 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.464 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.3 OUTLIER -111.31 125.34 53.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.235 179.136 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.462 ' CE1' HD13 ' A' ' 611' ' ' ILE . 73.2 m-85 -118.96 162.09 19.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.27 0.557 . . . . 0.0 111.935 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.03 138.56 10.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.861 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.54 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.78 151.6 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.065 0.46 . . . . 0.0 111.691 -179.576 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.435 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.6 mmtp -136.77 143.19 43.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.945 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -101.7 143.24 31.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.679 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.0 149.71 45.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.708 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.27 174.89 5.65 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.15 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.37 45.48 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.373 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -151.34 -17.47 0.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.957 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 105.44 36.5 2.84 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.343 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.516 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 87.5 m-20 -119.15 109.56 16.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.762 0.315 . . . . 0.0 110.827 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 627' ' ' LYS . 25.5 m -109.08 131.25 60.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.296 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -168.63 0.72 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.659 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -72.91 173.22 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.834 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.435 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -88.46 136.46 32.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.856 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.413 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.8 t -63.98 -174.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.273 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.53 143.71 48.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.686 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.544 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.68 127.59 32.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.281 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 640' ' ' VAL . 7.4 p -104.39 116.25 47.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.93 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.45 81.39 6.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.557 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 11.0 p -103.78 139.69 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.172 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.528 ' HG2' ' HA ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -111.54 155.53 23.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.654 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.246 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.757 0.313 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 21.3 mmt 60.76 -86.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -68.66 156.63 90.47 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.91 -144.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.663 2.242 . . . . 0.0 112.168 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.706 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -117.0 121.23 40.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.5 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.42 130.12 94.06 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.142 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.481 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.2 Cg_exo -48.95 170.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.808 2.339 . . . . 0.0 112.341 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 4.6 t -158.49 159.13 35.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.252 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 55.88 59.68 3.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.492 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.748 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.1 tp -85.58 155.51 21.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.658 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.74 175.52 12.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.322 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 18.8 p -123.72 134.23 53.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.6 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.99 -86.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.275 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.66 98.58 11.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.422 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.493 ' HB2' HG13 ' A' ' 576' ' ' ILE . 1.1 tt0 -111.36 134.5 52.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 24.1 p -126.18 -162.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 35.5 p -94.0 24.25 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.244 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 53.2 p -165.79 -47.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.1 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -114.57 126.82 55.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.186 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.493 HG13 ' HB2' ' A' ' 571' ' ' GLN . 18.1 tt -120.44 144.78 28.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.061 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -104.63 133.03 50.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.748 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -121.78 143.86 49.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.02 0.438 . . . . 0.0 111.386 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -139.4 138.59 36.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.396 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.584 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.4 p90 -153.55 169.67 22.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 111.269 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.49 128.37 33.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.184 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.54 169.64 2.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.706 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 11.3 p -67.9 -13.89 62.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.17 11.86 4.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.279 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -109.9 -65.05 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.634 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 41.1 t30 55.85 21.22 4.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.235 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.31 -25.25 36.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -162.78 2.11 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.405 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 10.2 t -64.93 146.27 13.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.32 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 629' ' ' ALA . 20.7 p -115.7 -38.96 3.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.46 176.82 40.97 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.717 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -117.85 149.29 41.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.724 0.297 . . . . 0.0 110.724 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.56 116.28 20.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.876 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.98 137.52 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -99.44 168.75 9.79 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.087 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.572 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 44.3 t30 -135.15 88.07 2.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.541 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 93.84 -64.13 1.8 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.238 -179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -152.96 -39.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -90.27 171.15 9.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -75.06 133.12 41.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -99.8 -107.44 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.91 168.02 12.0 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.156 0.503 . . . . 0.0 111.554 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 16.6 m -131.49 133.5 45.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.542 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.2 m -137.87 -174.07 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.561 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.477 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.5 p -138.88 -15.87 1.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.045 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.68 -146.96 20.85 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.743 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.7 p -104.65 20.27 18.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 111.194 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.44 ' O ' HG11 ' A' ' 604' ' ' VAL . 38.6 p -136.49 160.88 37.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.964 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.32 148.3 42.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.0 106.25 7.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 575' ' ' SER . 2.7 mp -99.91 122.86 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.807 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 83.1 p -100.32 172.6 7.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.928 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 75.73 -87.71 0.85 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.373 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.447 ' HB3' ' H ' ' A' ' 615' ' ' ALA . 1.5 mt 47.62 -156.92 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.836 0.351 . . . . 0.0 111.505 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 615' ' ' ALA . . . . . 0.447 ' H ' ' HB3' ' A' ' 614' ' ' LEU . . . -164.58 134.74 3.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.791 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -81.96 166.11 20.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.496 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.69 35.92 24.67 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.172 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.33 168.53 19.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.215 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.84 120.72 40.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.192 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -122.9 151.0 42.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.098 0.475 . . . . 0.0 111.993 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -124.87 130.2 51.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.756 178.837 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.449 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 84.2 m-85 -114.63 155.75 25.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.419 0.628 . . . . 0.0 112.385 -178.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.7 p -149.14 148.55 29.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.502 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.584 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -116.54 153.87 18.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.983 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 0.5 OUTLIER -140.0 171.64 13.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.664 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.9 125.97 38.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.316 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -116.23 152.09 34.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.998 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -109.68 176.43 5.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.926 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 629' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 590' ' ' THR . . . -90.22 45.95 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.208 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.38 -28.44 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.045 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 123.1 6.71 7.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.343 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -96.94 119.9 36.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.6 p -115.9 147.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.91 -159.72 0.4 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.599 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.5 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.14 177.07 6.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.901 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -87.84 150.54 23.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.979 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.474 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -86.1 -171.87 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -64.93 159.77 22.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -100.81 123.76 45.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.22 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.7 p -99.89 123.34 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.03 103.51 15.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.671 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -107.52 146.32 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.222 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -104.19 108.15 19.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.732 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.138 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.77 0.319 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 2.7 ptp -104.71 -70.89 0.76 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.937 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -63.35 143.41 97.78 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.156 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.426 ' HD3' ' HB2' ' A' ' 632' ' ' ASN . 70.7 Cg_endo -72.99 -153.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.616 2.211 . . . . 0.0 112.314 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 2.4 m -116.11 136.17 53.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -74.9 128.67 84.77 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.151 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.411 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 77.0 Cg_exo -47.45 154.4 1.64 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.681 2.254 . . . . 0.0 112.211 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.84 153.83 47.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.295 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 57.03 66.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.359 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.828 HD11 ' HG ' ' A' ' 578' ' ' LEU . 36.3 tp -86.93 159.8 18.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.276 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.479 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.44 172.93 15.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 0.0 111.732 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.39 135.03 49.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.176 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.68 -85.86 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.775 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 570' ' ' ALA . . . . . 0.474 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -85.08 102.88 13.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.863 0.364 . . . . 0.0 111.482 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.88 130.61 55.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 63.6 p -124.32 -156.81 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.297 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.2 p -94.69 22.58 6.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.408 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.502 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.2 p -164.71 -48.76 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.123 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.68 164.53 11.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.935 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.406 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 12.3 tt -158.29 145.6 8.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.329 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.474 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.0 m -107.32 136.11 47.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.497 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.828 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -127.63 125.5 40.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.872 0.367 . . . . 0.0 111.313 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 29.2 t -121.67 137.92 54.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.354 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.565 ' CD2' HG11 ' A' ' 624' ' ' VAL . 46.4 p90 -150.5 169.7 20.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.36 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 29.9 m -82.24 139.54 34.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.039 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.52 167.93 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.935 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 90.6 p -69.83 -3.98 18.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 9.9 p 52.52 24.36 3.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.007 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -124.0 -54.45 1.72 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 45.62 -154.74 0.04 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.825 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.4 t 54.32 19.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.151 0.501 . . . . 0.0 110.595 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -170.74 -28.79 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.801 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 591' ' ' GLY . 15.5 t -80.01 134.8 26.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.529 0.205 . . . . 0.0 110.629 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.494 HG21 ' HB2' ' A' ' 629' ' ' ALA . 31.4 p -124.96 23.96 7.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.75 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 152.16 167.86 15.71 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.247 -0.977 . . . . 0.0 113.182 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.27 127.27 37.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.85 0.357 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.656 ' HB3' HD11 ' A' ' 600' ' ' LEU . 2.7 m-20 -105.39 116.96 32.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.338 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.31 137.37 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.933 0.397 . . . . 0.0 111.268 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.422 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 87.1 m-85 -99.68 169.4 9.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.269 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -133.96 84.53 2.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 597' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 598' ' ' THR . . . 91.15 -52.66 3.19 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.224 -179.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.7 OUTLIER -158.53 -50.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.736 0.303 . . . . 0.0 111.225 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.85 173.48 12.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.958 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -79.33 149.29 31.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.418 ' N ' ' HG ' ' A' ' 600' ' ' LEU . . . -116.34 -104.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.748 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.417 ' CG2' ' HB1' ' A' ' 609' ' ' ALA . 9.9 t -90.92 162.65 14.67 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 111.151 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 22.8 m -127.33 117.13 21.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.899 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 609' ' ' ALA . 19.8 m -124.22 -173.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.507 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.75 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 25.1 p -140.75 -11.86 1.0 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.056 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.58 -140.84 11.56 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.632 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.93 27.99 9.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.786 0.326 . . . . 0.0 111.317 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.522 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.3 OUTLIER -149.93 153.24 36.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.949 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.735 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -137.49 144.09 42.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.028 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 34.5 m -122.35 110.89 16.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.281 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.406 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.6 mp -105.24 122.02 58.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.957 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 7.7 t -117.68 170.39 8.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.856 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 76.83 52.62 5.74 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.383 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 574' ' ' SER . 6.6 mt -122.27 161.8 22.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.87 0.367 . . . . 0.0 110.926 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.81 158.77 16.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -85.57 164.72 17.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.254 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 37.9 t0 55.91 42.33 28.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.222 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.5 m -140.54 139.24 35.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.407 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.68 136.43 35.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.237 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -135.73 118.66 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 111.739 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.97 107.4 18.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.906 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -99.52 160.48 14.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.363 0.602 . . . . 0.0 112.035 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 638' ' ' ASN . 4.5 p -150.89 152.88 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.835 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -113.83 152.87 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 111.482 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.0 mmtt -140.17 148.95 42.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.192 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -107.64 139.18 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.111 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.2 149.68 52.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.989 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -113.73 169.89 8.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.866 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 629' ' ' ALA . . . . . 0.494 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -81.75 7.81 11.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.151 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -104.15 -11.35 17.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.999 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 100.97 15.04 29.65 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.445 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.426 ' HB2' ' HD3' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -97.18 141.21 30.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.3 t -133.78 129.33 54.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.02 -171.59 2.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.41 176.0 10.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.18 134.5 34.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 5.0 t -66.0 -179.46 0.74 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.149 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 638' ' ' ASN . . . . . 0.412 ' O ' HG22 ' A' ' 623' ' ' THR . 0.8 OUTLIER -59.47 163.2 4.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.704 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -96.37 129.04 43.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.42 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.97 105.64 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 73.5 m -84.56 96.17 9.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 1.7 m -113.8 126.56 71.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.984 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -86.63 144.4 27.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.098 179.793 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 13.2 m80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.83 0.348 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -109.96 76.84 1.01 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.785 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.517 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -77.78 153.8 80.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -72.72 -165.55 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.506 2.137 . . . . 0.0 112.336 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.77 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 22.8 m -94.2 136.87 34.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.697 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -74.14 129.63 84.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.117 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.541 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -46.45 146.98 4.51 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.486 2.124 . . . . 0.0 112.053 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.1 154.21 51.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.968 0.413 . . . . 0.0 111.646 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.72 70.38 0.64 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.466 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.661 HD23 ' HB ' ' A' ' 640' ' ' VAL . 23.9 tp -83.63 159.59 21.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.391 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.529 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.95 169.77 21.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.834 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.478 ' HA ' HD23 ' A' ' 578' ' ' LEU . 0.0 OUTLIER -124.69 134.2 52.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.417 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.6 p -109.8 -89.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.533 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.52 99.95 12.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.83 0.347 . . . . 0.0 111.367 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.524 ' HB2' HG13 ' A' ' 576' ' ' ILE . 2.8 tm0? -122.6 120.85 34.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.8 p -110.18 -160.25 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.989 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 68.1 p -93.07 27.96 2.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.055 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.6 p -165.71 -58.6 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -102.73 129.57 49.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.93 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.524 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.0 tt -120.76 142.89 34.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.387 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 3.1 m -117.21 126.68 53.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.494 ' O ' ' HA ' ' A' ' 608' ' ' THR . 87.5 mt -119.85 146.44 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.525 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 144.72 51.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.995 179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CH2' HG11 ' A' ' 624' ' ' VAL . 47.8 p90 -154.61 170.18 22.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 111.282 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.52 131.22 34.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.815 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.06 176.66 0.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.405 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.77 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 23.7 p -74.55 147.18 41.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.968 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -10.73 59.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.178 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -91.42 -63.13 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 55.81 29.75 14.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.039 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.55 -24.88 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -163.4 6.53 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.9 121.56 13.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 111.112 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.441 HG21 ' HB2' ' A' ' 629' ' ' ALA . 1.3 t -119.48 -29.77 5.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.27 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.669 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -139.78 174.77 22.18 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.748 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.58 162.71 31.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.72 0.295 . . . . 0.0 110.691 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.09 119.11 20.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.858 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.674 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.69 146.27 9.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.866 0.365 . . . . 0.0 110.988 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 34.5 m-85 -120.17 164.66 15.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.822 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -140.32 87.6 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.627 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 67.63 71.35 0.95 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.153 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.7 p 47.49 39.6 9.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.928 0.394 . . . . 0.0 111.221 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -160.33 102.05 1.39 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.057 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -49.21 136.3 15.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.154 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -111.91 -98.4 0.42 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.306 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 594' ' ' VAL . 6.5 t -90.6 170.68 9.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.305 0.574 . . . . 0.0 111.983 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.8 m -136.54 137.26 40.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.864 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.632 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.3 m -132.03 -176.1 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.929 0.395 . . . . 0.0 111.955 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.669 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.7 p -130.61 -6.92 4.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.734 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.78 -147.38 9.71 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.536 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.2 p -100.18 1.99 42.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.694 0.283 . . . . 0.0 111.456 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.535 ' O ' HG21 ' A' ' 604' ' ' VAL . 11.6 p -114.32 165.58 12.56 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.632 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -151.03 134.13 15.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.2 m -121.84 122.77 40.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.307 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.478 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.8 mp -112.76 128.65 69.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.779 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.0 155.46 20.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.0 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 78.45 58.05 3.21 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.509 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.0 mt -115.01 154.5 28.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -103.43 144.77 30.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.021 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -87.39 164.2 16.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.65 35.27 22.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.87 156.93 47.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.336 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.3 t -95.05 137.53 33.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -139.41 134.73 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 111.269 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 37.4 p -114.21 125.65 54.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.078 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.404 ' CE2' HD13 ' A' ' 576' ' ' ILE . 92.8 m-85 -113.46 155.14 25.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.279 0.562 . . . . 0.0 111.957 -179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.51 122.58 5.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.827 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.674 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.1 OUTLIER -99.25 157.55 3.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.139 0.495 . . . . 0.0 112.029 -178.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 5.7 mttt -136.85 163.54 30.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.411 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.431 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -111.08 133.55 53.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 0.0 111.089 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -126.36 143.84 51.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.958 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -107.52 156.26 19.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.822 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 629' ' ' ALA . . . . . 0.441 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -82.51 62.69 6.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.405 ' HB3' ' OD1' ' A' ' 628' ' ' ASP . . . -157.89 -39.11 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.974 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 134.06 44.15 0.12 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.771 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 63.3 m-80 -141.91 147.95 37.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.728 0.299 . . . . 0.0 110.927 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -137.36 144.99 30.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.209 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 8.2 p -87.4 -164.69 1.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.752 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.697 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.88 177.49 6.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.548 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.558 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.75 141.55 31.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 111.228 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.541 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -72.29 -177.39 2.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.922 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.39 144.18 47.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.689 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.94 112.29 17.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.323 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.661 ' HB ' HD23 ' A' ' 566' ' ' LEU . 1.2 t -100.02 137.13 28.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.591 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.8 m -116.53 109.92 17.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.984 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.8 p -115.37 149.72 17.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.996 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -114.86 128.99 56.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.036 179.816 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.764 0.316 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 558' ' ' MET . . . . . 0.482 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 2.9 mtt -147.31 -98.0 0.09 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.117 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.483 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -68.67 141.41 92.79 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.684 0.278 . . . . 0.0 111.159 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.448 ' HB3' HG22 ' A' ' 589' ' ' VAL . 85.2 Cg_endo -81.28 -157.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.629 2.219 . . . . 0.0 112.418 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.86 150.29 28.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.79 128.06 64.92 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.402 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.6 Cg_exo -48.1 153.05 3.0 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.703 2.269 . . . . 0.0 112.146 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.07 160.19 41.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.464 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 59.64 45.36 13.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.248 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.456 HD12 ' H ' ' A' ' 567' ' ' ALA . 63.9 tp -68.07 158.12 33.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.76 0.314 . . . . 0.0 110.68 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.456 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -162.07 -176.74 5.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.321 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.505 ' HA ' HD23 ' A' ' 578' ' ' LEU . 83.8 p -123.37 156.64 35.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.32 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.49 -89.4 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.727 0.299 . . . . 0.0 111.478 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.04 101.46 13.8 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.19 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.82 99.75 7.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.966 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 19.6 p -95.2 -155.18 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.812 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 14.4 p -96.99 19.59 12.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.51 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.546 ' O ' HD12 ' A' ' 614' ' ' LEU . 92.8 p -165.93 -46.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.136 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.78 137.88 39.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.434 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -133.1 141.25 45.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.43 131.84 55.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.011 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 76.2 mt -121.89 134.96 54.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.906 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 5.5 t -118.76 140.61 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.679 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.529 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.6 p90 -152.67 169.72 22.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.085 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.4 m -84.68 115.23 22.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -50.92 153.35 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.199 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.93 142.42 15.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.764 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 23.2 p -59.84 -15.35 20.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.228 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -112.46 153.91 26.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.034 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.482 ' C ' ' H ' ' A' ' 588' ' ' GLY . 2.3 p30 -153.06 -157.83 0.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.548 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.405 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 28.2 t 71.29 -22.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.365 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 588' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -124.8 -20.84 2.25 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.088 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.448 HG22 ' HB3' ' A' ' 560' ' ' PRO . 96.4 t -70.13 141.8 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 110.693 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -102.42 -67.07 0.89 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.8 -179.336 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.632 ' H ' HG23 ' A' ' 590' ' ' THR . . . -145.38 -176.36 19.27 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.005 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -121.79 127.35 50.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.887 0.375 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.44 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 5.5 m-20 -101.65 118.3 36.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.423 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.73 135.18 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.957 0.408 . . . . 0.0 110.909 -179.791 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.728 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.0 m-85 -102.59 151.1 22.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.847 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -127.74 93.14 3.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.178 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 50.7 72.93 0.42 Allowed Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.926 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.5 p 50.07 37.41 14.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.075 0.464 . . . . 0.0 110.931 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.9 94.66 1.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.728 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.728 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.3 tt -44.92 129.96 7.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.441 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.58 -103.05 0.19 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.129 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.4 ' O ' HG13 ' A' ' 594' ' ' VAL . 12.5 t -90.65 172.51 8.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.139 0.495 . . . . 0.0 111.683 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 603' ' ' THR . . . . . 0.428 HG23 ' OD1' ' A' ' 593' ' ' ASP . 63.1 m -138.32 105.29 5.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.268 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.8 m -105.98 -167.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.576 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.603 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.0 p -142.88 -0.55 1.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.031 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.88 -143.02 7.75 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.655 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.422 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 4.8 p -104.39 6.92 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.086 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -126.22 141.38 51.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.303 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -127.15 117.81 23.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.961 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.19 118.94 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.235 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.434 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -111.86 129.78 66.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.081 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 6.6 p -117.33 142.49 47.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 97.55 64.2 0.89 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.51 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.546 HD12 ' O ' ' A' ' 574' ' ' SER . 3.5 mt -130.86 158.47 40.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.846 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -110.64 138.73 46.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.154 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.83 172.37 8.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.177 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 28.4 t0 56.32 34.91 24.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.262 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.21 141.7 35.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.484 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.92 130.09 35.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.617 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -130.78 142.1 50.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.92 0.391 . . . . 0.0 111.501 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 1.3 m -120.4 133.35 55.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.342 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -121.88 156.79 32.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 0.0 112.068 -179.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 3.1 p -152.53 131.6 12.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.587 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.529 HG11 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -98.84 153.43 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.303 0.573 . . . . 0.0 111.804 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.637 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mttt -140.5 143.39 35.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.492 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -103.76 116.52 32.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 0.0 111.741 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.44 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -108.52 149.53 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.537 179.524 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.44 160.25 14.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.754 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.41 50.39 1.45 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.424 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -155.87 -35.19 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.012 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 132.21 39.74 0.22 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.396 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.483 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 1.5 t-20 -136.16 116.57 13.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.7 p -116.44 146.08 21.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.007 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.25 -167.0 1.7 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -77.14 -179.29 5.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.097 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.19 144.78 25.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.999 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.407 ' OG ' HG23 ' A' ' 624' ' ' VAL . 2.5 p -75.58 -174.89 2.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.917 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -64.9 150.1 48.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.785 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -83.92 128.19 34.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.204 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -111.78 105.39 18.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.991 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.2 91.44 8.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.973 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -99.61 171.61 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -143.5 128.8 18.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.839 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.139 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.884 0.373 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 66.3 mtt -81.25 4.47 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -59.0 152.48 50.18 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.57 -152.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.485 2.123 . . . . 0.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.601 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 17.8 m -113.67 127.75 56.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.119 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.521 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -61.42 131.72 92.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.445 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.51 159.61 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.883 2.389 . . . . 0.0 112.141 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.4 p -134.49 138.03 44.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.997 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.73 84.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.202 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.871 HD11 ' HG ' ' A' ' 578' ' ' LEU . 10.6 tp -90.63 159.39 16.44 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.615 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.73 164.46 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.037 0.446 . . . . 0.0 111.805 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.445 ' HA ' HD12 ' A' ' 578' ' ' LEU . 47.3 p -111.55 138.44 48.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.256 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.66 -89.88 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 570' ' ' ALA . . . . . 0.425 ' H ' ' HB ' ' A' ' 577' ' ' THR . . . -89.71 102.76 15.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 111.461 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.462 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.69 143.49 46.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.69 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.431 ' N ' ' HG2' ' A' ' 571' ' ' GLN . 24.6 p -129.92 -159.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.957 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.401 ' H ' ' HB ' ' A' ' 572' ' ' THR . 42.9 p -89.65 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.658 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.8 p -142.04 -50.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.791 0.329 . . . . 0.0 111.212 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -101.58 167.25 10.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.85 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.462 HG13 ' HB2' ' A' ' 571' ' ' GLN . 15.1 tt -155.92 147.42 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.425 ' HB ' ' H ' ' A' ' 570' ' ' ALA . 20.8 m -110.02 142.34 41.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.805 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.871 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.8 OUTLIER -132.89 133.4 43.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -127.55 139.95 52.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.507 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 45.0 p90 -154.39 169.68 23.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.3 m -81.5 138.15 35.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.335 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.39 171.84 8.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.223 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.601 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.9 OUTLIER -73.35 179.12 4.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.774 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -11.07 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.323 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -77.79 -63.98 1.26 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.051 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.8 m120 56.67 -161.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.774 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t 52.95 25.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.128 0.489 . . . . 0.0 110.655 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.97 -30.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.991 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.402 HG22 ' OD1' ' A' ' 628' ' ' ASP . 33.5 t -66.83 138.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.709 0.29 . . . . 0.0 110.508 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -107.55 -65.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.629 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -136.42 -164.79 10.33 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.31 -0.947 . . . . 0.0 113.251 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.423 ' HB2' ' HZ2' ' A' ' 580' ' ' TRP . 95.3 m-85 -135.25 138.86 43.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.738 0.304 . . . . 0.0 111.009 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.14 119.22 38.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.414 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.2 137.78 25.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -104.13 147.76 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.726 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -109.05 84.15 1.87 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.323 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.5 -77.78 1.98 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -142.56 12.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.995 0.426 . . . . 0.0 111.138 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -132.69 174.51 10.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.382 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.95 133.91 34.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.77 0.319 . . . . 0.0 110.516 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.21 -108.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.692 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.4 t -91.79 171.83 8.88 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.303 0.573 . . . . 0.0 111.813 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.6 124.66 27.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.913 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.6 m -121.67 175.02 5.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.928 0.394 . . . . 0.0 112.027 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.504 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -132.56 -14.87 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.942 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -95.94 -108.98 2.42 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.597 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.72 -29.49 1.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.569 0.223 . . . . 0.0 111.489 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.537 ' O ' HG11 ' A' ' 604' ' ' VAL . 2.4 p -88.32 -177.04 5.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.188 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.671 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -160.68 133.04 6.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.977 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.2 m -119.01 110.35 17.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.072 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.414 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.8 mp -103.48 124.34 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.825 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 70.3 m -109.06 168.09 9.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 79.89 52.21 4.76 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.666 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 17.2 mt -118.13 165.75 13.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -127.44 131.93 50.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -68.53 176.32 2.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.285 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 59.43 22.25 10.72 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.44 151.32 44.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.364 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 67.6 m -92.37 146.1 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.325 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -139.6 128.88 23.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.91 0.385 . . . . 0.0 111.702 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.03 134.99 46.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.835 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -128.65 163.42 25.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.373 0.606 . . . . 0.0 112.159 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.1 p -147.54 164.8 32.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.83 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.471 HG23 ' CB ' ' A' ' 637' ' ' SER . 0.0 OUTLIER -135.01 142.46 40.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 111.548 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.7 mttt -131.25 162.87 29.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.737 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.9 132.46 55.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.179 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -123.65 154.6 39.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.402 ' OD1' HG22 ' A' ' 589' ' ' VAL . 0.6 OUTLIER -115.45 -179.91 3.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.894 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.95 -3.41 57.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -100.21 -0.09 39.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.025 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.27 35.25 15.12 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.652 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.468 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 9.8 m120 -116.32 132.92 56.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 0.0 110.919 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.8 p -120.2 147.19 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.094 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.41 -152.05 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.579 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.521 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.35 174.15 7.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.967 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.493 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.13 130.74 36.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.124 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.471 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -67.99 -178.71 1.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.76 150.48 36.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.749 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -90.07 125.08 35.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.507 ' HB ' HD23 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -102.39 150.63 6.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.774 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.83 125.97 54.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 6.4 p -127.4 134.99 64.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.934 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.1 111.84 24.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.934 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 19.0 m170 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.755 0.312 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.9 mmt 55.23 -160.14 0.18 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -62.26 150.78 83.7 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.555 ' HB3' HG22 ' A' ' 589' ' ' VAL . 57.2 Cg_endo -70.68 -152.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.508 2.138 . . . . 0.0 112.134 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -116.55 125.72 52.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.927 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.503 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.19 124.22 73.54 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.942 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.47 144.52 7.11 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.466 2.111 . . . . 0.0 112.105 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 51.2 p -132.66 155.44 48.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.401 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t30 58.76 64.46 1.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.447 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.0 tp -88.3 156.71 19.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.233 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.666 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.13 172.38 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.961 0.41 . . . . 0.0 111.589 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.464 ' HA ' HD12 ' A' ' 578' ' ' LEU . 40.1 p -118.18 128.96 55.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.354 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.9 p -99.87 -87.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.521 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.44 96.66 10.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 111.438 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.585 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.9 tt0 -112.26 136.32 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.771 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.7 p -130.66 -162.14 1.19 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.096 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.4 p -91.86 6.66 45.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.451 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.449 ' O ' HD12 ' A' ' 614' ' ' LEU . 77.0 p -135.95 -56.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.24 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.573 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 10.9 t -113.91 158.45 21.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.585 HD12 ' HG3' ' A' ' 571' ' ' GLN . 15.4 tt -142.0 136.33 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 1.7 m -99.72 129.55 45.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.646 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -119.08 133.15 55.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.097 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 84.8 p -125.7 146.95 49.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.291 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.424 ' HB3' HD12 ' A' ' 566' ' ' LEU . 49.1 p90 -159.2 170.33 22.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.936 0.398 . . . . 0.0 111.379 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.33 133.18 36.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -71.0 174.66 5.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.07 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 t -83.2 149.37 26.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.877 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 3.9 p -75.43 -7.7 54.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 589' ' ' VAL . 72.9 m-20 -125.25 67.83 1.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.738 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.77 3.91 13.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.96 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.64 -12.22 15.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.047 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.75 -32.14 0.57 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.543 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.555 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.1 t -61.13 150.39 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.733 0.302 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.11 -50.6 1.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.426 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -147.3 175.15 26.81 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.813 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -122.59 157.86 31.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.794 0.33 . . . . 0.0 110.978 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.68 120.88 16.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 623' ' ' THR . 0.2 OUTLIER -101.25 137.16 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.955 0.407 . . . . 0.0 110.731 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 59.2 m-85 -104.07 147.85 26.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.75 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -99.69 84.29 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.132 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 88.11 -62.26 3.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.125 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.4 -20.7 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.994 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -96.07 163.63 13.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.915 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -80.05 118.14 21.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.722 0.296 . . . . 0.0 110.465 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -90.09 -106.38 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.939 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.0 t -91.1 167.68 12.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.103 0.477 . . . . 0.0 111.358 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.31 130.02 38.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.214 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.823 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.2 m -131.79 -178.8 2.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.581 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 65.6 p -135.67 -17.09 1.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -94.83 -139.08 9.8 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.01 16.92 19.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.291 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -133.89 170.38 15.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.053 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.823 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -148.55 140.93 24.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.849 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -125.95 113.13 16.76 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.476 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.573 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -110.39 108.36 25.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.788 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.8 166.8 10.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.967 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 82.48 32.42 27.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.437 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 574' ' ' SER . 10.8 mt -92.83 166.95 12.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.857 0.36 . . . . 0.0 111.097 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -116.36 147.08 41.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.744 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -78.18 162.09 26.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.506 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 58.43 38.02 25.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.408 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.48 147.01 38.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.348 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.17 144.04 28.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.55 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -137.86 153.4 49.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 111.767 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.538 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -125.02 139.44 53.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.098 179.169 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.465 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 44.9 m-85 -132.75 152.07 51.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 112.327 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 45.4 p -146.57 128.51 15.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.659 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.516 HG22 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.53 147.47 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 1.8 mttt -132.43 169.8 16.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.499 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.08 130.88 48.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.867 0.365 . . . . 0.0 111.379 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -121.02 147.15 45.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.723 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.37 171.93 7.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.06 40.5 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.198 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -139.9 -41.44 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.076 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 142.1 -9.27 2.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.643 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -83.1 137.64 34.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 111.033 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -129.74 148.61 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.931 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.99 -164.11 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.503 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.08 178.01 6.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.024 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -85.69 149.37 25.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.414 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -82.61 -175.8 5.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.896 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -62.2 160.84 12.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.2 131.65 39.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 621' ' ' THR . 13.6 p -115.59 134.05 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 8.3 t -104.99 130.24 53.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -117.05 150.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.973 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.64 88.74 2.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.121 -179.986 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.692 0.282 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' MET . . . . . 0.5 ' HB3' ' H ' ' A' ' 559' ' ' ALA . 0.6 OUTLIER 54.68 -152.33 0.34 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.5 ' H ' ' HB3' ' A' ' 558' ' ' MET . . . -59.68 147.95 76.51 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.848 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 628' ' ' ASP . 70.0 Cg_endo -73.41 -178.77 3.88 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.442 2.095 . . . . 0.0 112.319 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.61 154.71 36.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.69 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -91.86 129.97 40.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.334 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.47 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 77.3 Cg_exo -50.12 151.4 9.1 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.511 2.141 . . . . 0.0 111.749 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 45.5 p -139.19 156.89 46.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 111.693 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.54 54.19 5.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.779 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.831 HD11 ' HG ' ' A' ' 578' ' ' LEU . 16.5 tp -82.38 156.27 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.682 0.277 . . . . 0.0 110.302 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.543 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.04 179.66 7.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.998 0.428 . . . . 0.0 111.67 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 93.2 p -126.75 123.17 36.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.178 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.6 -87.27 0.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.846 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 570' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -79.78 97.9 6.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.7 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -113.33 119.48 37.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.528 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 11.6 p -113.77 -161.02 0.75 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.006 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 30.1 p -91.46 20.55 5.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -167.68 -46.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.736 0.303 . . . . 0.0 111.405 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -105.77 130.69 53.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.216 -179.682 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.1 tt -121.05 147.34 24.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.214 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 31.8 m -111.65 131.38 55.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.698 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.831 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.5 tp -121.66 130.44 53.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 11.1 t -126.76 136.59 52.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.68 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.61 ' HH2' HG21 ' A' ' 604' ' ' VAL . 40.9 p90 -150.98 170.41 19.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.837 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.8 m -79.39 127.35 31.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 582' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -61.7 133.31 55.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.1 m -72.04 151.92 42.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -177.51 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 49.6 m-20 54.63 53.4 10.69 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.92 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -65.76 -10.33 36.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.882 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.5 m -66.68 -10.22 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.258 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -125.28 -34.8 0.65 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.552 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 627' ' ' LYS . 2.8 t -65.7 130.27 30.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 111.048 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.01 -23.06 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.181 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -175.9 178.22 47.44 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.65 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -126.03 126.31 44.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.826 0.346 . . . . 0.0 111.014 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.75 118.7 37.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.54 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.81 130.62 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.5 m-85 -99.67 154.51 18.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.677 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -136.47 90.22 2.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.499 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 70.19 59.55 5.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.148 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.6 p 53.58 40.49 31.49 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.962 0.41 . . . . 0.0 111.393 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.84 111.44 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.907 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -48.6 124.28 8.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.336 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -100.75 -106.39 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.081 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.5 t -91.02 167.67 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.139 0.495 . . . . 0.0 111.525 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 6.6 m -131.78 129.02 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.376 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.688 HG11 ' HA ' ' A' ' 609' ' ' ALA . 14.9 m -130.32 -170.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.528 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.606 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.9 p -145.65 -26.69 0.46 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.97 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -79.03 -113.42 0.22 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.913 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 7.4 p -139.14 3.65 2.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.736 0.303 . . . . 0.0 111.241 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.573 ' O ' HG11 ' A' ' 604' ' ' VAL . 41.1 p -129.46 146.34 51.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.688 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -124.06 136.02 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.031 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.34 129.47 54.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.7 mp -125.45 119.53 55.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.065 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.99 131.44 55.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.007 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 115.99 60.1 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.625 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.5 mt -129.61 173.89 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.724 0.297 . . . . 0.0 110.698 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -132.3 145.01 50.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.74 173.31 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.172 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 55.34 38.17 29.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.64 161.43 36.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.399 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 m -119.99 127.46 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.591 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -123.89 149.49 45.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.997 0.427 . . . . 0.0 111.215 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 44.5 p -124.3 106.13 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.395 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.415 ' CE1' HD13 ' A' ' 611' ' ' ILE . 94.5 m-85 -100.0 157.75 16.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.212 0.53 . . . . 0.0 111.749 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.5 p -152.38 134.66 15.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.731 179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.724 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.37 141.1 17.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.277 0.561 . . . . 0.0 111.975 -179.158 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.596 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -130.03 152.21 49.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.551 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.604 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -110.15 144.26 39.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.466 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -122.12 176.71 5.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.543 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.647 ' HB3' ' HD3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -138.45 172.15 13.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.84 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.82 42.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.368 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -150.16 -6.69 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.165 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 93.13 35.52 6.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.444 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -119.17 138.91 52.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 35.5 m -114.65 151.6 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.604 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 0.7 OUTLIER -90.33 -157.78 0.5 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.394 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.69 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.76 156.96 18.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.791 0.329 . . . . 0.0 110.652 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.596 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.05 116.01 19.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.821 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.413 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -56.84 173.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.162 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -58.03 147.49 29.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.45 139.92 36.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.076 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.6 m -116.51 103.57 15.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.968 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 14.5 t -83.6 106.32 15.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.862 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.432 HG11 ' CD1' ' A' ' 576' ' ' ILE . 10.9 p -109.07 145.12 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.157 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 644' ' ' THR . 0.2 OUTLIER -120.29 111.49 17.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.722 179.73 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 644' ' ' THR . . . . . 0.458 ' O ' ' HE2' ' A' ' 643' ' ' LYS . 69.6 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.259 -0.876 . . . . 0.0 111.18 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 . . . . . 0 N--CA 1.488 1.425 0 CA-C-O 120.717 0.294 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 558' ' ' MET . . . . . 0.413 ' H ' ' HG2' ' A' ' 558' ' ' MET . 0.0 OUTLIER -95.4 22.57 6.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.747 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.469 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -64.37 148.86 95.66 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.018 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.81 -163.97 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.54 2.16 . . . . 0.0 112.343 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 583' ' ' SER . 5.0 m -100.29 124.63 45.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.101 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.434 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -62.97 129.65 93.48 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.486 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 85.0 Cg_exo -45.78 151.89 1.18 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.911 2.407 . . . . 0.0 112.295 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.2 p -136.17 155.49 50.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.9 0.381 . . . . 0.0 111.534 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 59.5 t30 57.23 67.47 0.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.576 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.856 HD11 ' HG ' ' A' ' 578' ' ' LEU . 15.2 tp -86.69 159.31 19.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.0 179.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.561 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.89 167.37 26.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.985 0.421 . . . . 0.0 111.888 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 4.6 p -121.23 146.65 46.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.334 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.1 p -125.98 -86.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.446 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 576' ' ' ILE . . . -82.15 97.93 8.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.194 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.98 95.28 4.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -84.45 -154.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.185 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.49 -11.55 39.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.69 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.7 p -136.82 -40.18 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.64 162.45 13.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.176 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -156.46 149.32 10.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.862 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.424 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.4 m -119.04 140.06 50.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.75 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.856 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -124.06 149.65 45.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.86 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 9.7 t -142.74 131.27 22.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.211 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.502 ' HB3' HD12 ' A' ' 566' ' ' LEU . 43.5 p90 -149.56 169.65 20.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.204 -179.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 m -79.89 143.61 34.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.961 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.44 170.18 0.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.442 ' O ' ' HB ' ' A' ' 561' ' ' THR . 2.2 p -69.87 -5.4 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.53 16.45 5.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -152.49 72.11 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.675 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.503 ' HB2' ' H ' ' A' ' 587' ' ' VAL . 0.2 OUTLIER -70.24 -128.87 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.721 -179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.503 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 4.2 m 44.1 26.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.119 0.485 . . . . 0.0 111.723 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -176.87 -37.62 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.918 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.67 144.4 13.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.564 0.221 . . . . 0.0 110.559 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.3 t -132.43 -30.11 1.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.748 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.49 172.41 30.98 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.011 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -130.93 134.87 47.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.691 0.281 . . . . 0.0 110.647 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -99.99 128.45 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.796 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.404 ' HB ' HG22 ' A' ' 602' ' ' THR . 61.6 t -99.66 132.51 44.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.979 0.419 . . . . 0.0 111.308 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.447 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 52.2 m-85 -101.31 124.66 47.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.928 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.497 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 47.6 t30 -100.06 84.61 2.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.92 -80.8 0.79 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.277 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 4.5 p -147.18 16.98 1.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.783 0.325 . . . . 0.0 111.072 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -145.35 173.05 12.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.57 HD22 ' H ' ' A' ' 601' ' ' ALA . 1.4 tm? -71.07 149.93 46.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.825 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.57 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -132.92 -100.94 0.26 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.342 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 594' ' ' VAL . 14.0 t -90.13 172.65 8.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.916 0.388 . . . . 0.0 111.428 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 80.1 m -140.34 126.07 19.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.858 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 609' ' ' ALA . 7.0 m -126.36 -177.09 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.528 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.748 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 67.4 p -137.89 -11.34 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.27 -126.52 5.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.464 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 4.4 p -122.72 -4.39 8.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.749 0.309 . . . . 0.0 111.059 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.465 ' O ' HG11 ' A' ' 604' ' ' VAL . 17.2 p -111.23 173.59 6.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.024 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -155.45 127.74 7.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.075 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.9 m -114.14 112.91 23.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.157 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.9 mp -105.94 131.9 54.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.937 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 15.9 p -120.89 173.73 7.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.106 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 74.8 44.47 24.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.727 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.3 mt -117.7 132.52 56.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.818 0.342 . . . . 0.0 110.825 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.02 143.88 35.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.96 167.38 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.21 35.06 25.72 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.8 m -137.51 146.43 44.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.232 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.83 136.88 32.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -135.76 140.36 44.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 111.615 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.559 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 2.0 p -111.97 135.02 53.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.532 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.635 ' H ' HG12 ' A' ' 640' ' ' VAL . 54.5 m-85 -126.45 161.27 28.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.279 0.562 . . . . 0.0 112.396 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.529 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.26 159.11 31.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.768 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.415 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -124.14 152.61 29.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.047 0.451 . . . . 0.0 111.497 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.551 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 3.8 mttt -139.15 139.36 37.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.803 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.533 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -94.96 116.42 28.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.0 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -108.71 148.59 30.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.104 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -116.19 169.92 8.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.773 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.64 -13.84 59.62 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.159 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -83.8 5.62 24.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.046 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.03 2.86 90.68 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.404 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.6 m120 -95.81 123.47 39.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.761 0.315 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.5 p -120.91 136.79 56.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.533 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 1.9 p -69.03 -167.51 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.952 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.434 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.3 -178.46 5.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.751 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.551 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.16 146.0 28.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.6 p -82.64 -164.13 0.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.7 146.63 54.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.617 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.69 148.68 31.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.916 0.388 . . . . 0.0 111.163 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.635 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -114.7 158.46 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.767 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 44.7 t -143.94 105.52 4.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.769 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.87 140.01 48.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.098 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.09 102.02 9.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.672 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.139 -179.851 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.646 0.26 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.72 105.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.116 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 560' ' ' PRO . . . -56.3 159.42 6.24 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.232 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 559' ' ' ALA . 39.3 Cg_endo -65.48 -169.06 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.603 2.202 . . . . 0.0 112.396 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.95 118.12 28.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.126 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.599 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -60.17 127.29 85.84 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.406 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 88.4 Cg_exo -46.87 156.66 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.701 2.267 . . . . 0.0 112.034 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.52 159.32 40.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.449 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 60.0 49.94 7.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.287 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.841 HD11 ' HG ' ' A' ' 578' ' ' LEU . 56.9 tp -74.07 159.67 32.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.424 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.451 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -161.33 -176.81 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.435 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 35.3 p -133.89 130.59 38.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.332 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.5 p -104.09 -85.29 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.454 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.81 103.56 14.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.05 116.94 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.809 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -108.68 -161.43 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.081 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.54 16.98 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.452 ' O ' HD12 ' A' ' 614' ' ' LEU . 1.8 p -161.63 -43.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.186 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.7 167.11 10.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.633 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.5 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.3 tt -160.44 147.31 5.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.907 0.384 . . . . 0.0 111.27 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.4 m -116.55 134.41 54.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.642 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.841 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -118.76 133.94 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.082 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.32 132.98 48.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.431 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.621 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.8 p90 -148.29 169.74 19.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.175 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 7.2 m -81.32 115.57 20.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.979 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 582' ' ' ALA . . . . . 0.74 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -60.1 154.24 19.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.329 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 84.0 p -61.28 132.96 55.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.894 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -19.91 61.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.222 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -89.38 53.58 2.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.453 ' C ' ' H ' ' A' ' 588' ' ' GLY . 42.0 p-10 -72.54 -150.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 71.53 -17.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 588' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -132.66 -26.8 0.63 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.88 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.401 HG13 ' O ' ' A' ' 627' ' ' LYS . 83.4 t -66.87 145.25 13.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.725 0.297 . . . . 0.0 110.81 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.4 -67.09 0.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.48 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -143.61 -173.06 14.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.931 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -125.84 130.85 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 110.876 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -110.26 120.75 43.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.662 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.68 136.16 32.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.906 0.384 . . . . 0.0 110.764 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -99.35 174.97 6.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.157 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -140.63 84.43 1.95 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.357 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 597' ' ' GLY . . . . . 0.461 ' O ' HG23 ' A' ' 598' ' ' THR . . . 86.06 -66.22 3.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.233 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.461 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -163.11 31.76 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.859 179.727 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.65 137.06 11.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.068 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 601' ' ' ALA . 1.0 OUTLIER -56.66 136.22 54.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.202 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.459 ' N ' HD13 ' A' ' 600' ' ' LEU . . . -109.74 -104.3 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.969 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.7 t -90.44 163.09 14.79 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.079 0.466 . . . . 0.0 111.344 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.5 m -126.95 131.55 51.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.616 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.786 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -135.71 -179.92 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.417 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.2 p -136.87 -5.79 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.45 -124.16 5.32 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.585 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.74 HG22 ' HB2' ' A' ' 582' ' ' ALA . 80.5 p -129.48 9.76 5.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.733 0.302 . . . . 0.0 111.063 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.542 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 23.2 p -136.47 138.84 41.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.194 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.786 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.47 155.86 36.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.2 m -129.76 125.3 35.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.16 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.5 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.5 mt -121.68 119.61 59.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -107.42 173.64 6.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.03 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.66 59.09 8.05 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.612 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 574' ' ' SER . 12.4 mt -119.01 114.03 21.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.713 0.292 . . . . 0.0 111.005 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -65.21 133.67 52.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.15 173.18 3.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.69 35.32 25.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.049 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.3 m -140.36 142.92 35.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.459 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 t -99.95 111.92 24.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -105.25 127.6 53.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.552 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.622 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.1 OUTLIER -104.44 109.87 21.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.255 179.122 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.405 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 71.5 m-85 -102.19 161.71 13.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.331 0.586 . . . . 0.0 112.222 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.4 p -150.83 148.87 29.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.524 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -110.14 151.64 12.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.052 0.453 . . . . 0.0 111.784 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.0 mttt -139.93 150.18 44.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.006 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.411 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -112.17 121.84 46.07 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.898 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 589' ' ' VAL . 0.0 OUTLIER -115.44 158.42 22.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.25 -179.558 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.03 171.12 8.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.75 60.53 5.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.108 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -158.92 -43.78 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.68 16.37 0.61 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.496 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -111.99 125.11 53.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.339 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 28.4 m -119.67 142.65 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.355 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 31.7 p -77.68 -172.68 2.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.766 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.599 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.01 167.95 20.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.843 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -87.3 128.99 35.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.066 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.444 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.5 t -65.7 179.49 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.61 157.6 26.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.727 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.622 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -89.24 138.5 31.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.16 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.02 108.63 25.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.044 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.08 111.77 17.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.38 129.04 74.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -101.82 115.79 31.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.125 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 557' ' ' HIS . . . . . 0.421 ' N ' HD22 ' A' ' 632' ' ' ASN . 36.4 m80 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.736 0.303 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 54.92 50.97 14.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.787 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -55.85 154.13 14.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.324 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.564 ' HB3' HG22 ' A' ' 589' ' ' VAL . 92.0 Cg_endo -78.32 -158.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.6 2.2 . . . . 0.0 112.42 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 5.3 m -114.31 125.32 53.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.995 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.563 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.2 122.88 66.79 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.04 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.454 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.0 Cg_exo -48.42 159.33 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.539 2.159 . . . . 0.0 112.109 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 564' ' ' THR . . . . . 0.488 HG23 ' OG1' ' A' ' 581' ' ' THR . 0.0 OUTLIER -157.6 169.97 23.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.838 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 59.03 40.46 22.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.048 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.771 HD11 ' HG ' ' A' ' 578' ' ' LEU . 66.2 tp -66.79 157.41 32.97 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.725 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.405 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.36 -179.38 6.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.7 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 6.4 p -134.9 122.54 22.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.077 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.6 p -100.78 -88.2 0.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.745 0.307 . . . . 0.0 111.65 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.22 100.36 11.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.276 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.617 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.1 OUTLIER -118.48 114.15 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.745 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 13.2 p -100.77 -156.87 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.06 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.59 22.45 9.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.363 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 68.0 p -160.02 -49.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -113.28 131.08 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.024 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.617 HG13 ' HB2' ' A' ' 571' ' ' GLN . 17.2 tt -118.6 146.1 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.087 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 31.6 m -104.5 138.77 40.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.755 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.771 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -126.37 133.94 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.3 t -128.47 143.06 50.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.523 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.454 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 41.4 p90 -158.33 169.57 24.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.851 0.358 . . . . 0.0 111.169 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 581' ' ' THR . . . . . 0.488 ' OG1' HG23 ' A' ' 564' ' ' THR . 73.5 p -80.08 114.51 19.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.162 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.9 158.76 6.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.149 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.26 147.55 44.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.96 -5.61 49.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 589' ' ' VAL . 96.2 m-20 -126.35 73.27 1.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.908 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -85.31 18.87 2.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.3 p -81.14 -15.06 12.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.37 -24.31 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.608 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.564 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.8 t -61.67 143.51 14.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.774 0.321 . . . . 0.0 111.207 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 4.7 t -113.48 -15.98 12.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 171.24 -174.54 44.91 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.718 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -131.04 128.85 41.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.075 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.754 ' HB3' HD21 ' A' ' 600' ' ' LEU . 4.2 m-20 -111.14 117.8 34.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.552 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.34 139.0 22.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.999 0.428 . . . . 0.0 111.103 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.437 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.2 m-85 -99.4 150.29 22.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.231 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.405 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 16.8 t30 -113.7 84.53 2.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.961 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.82 -65.45 1.19 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.093 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -154.74 -27.04 0.12 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.755 0.312 . . . . 0.0 111.152 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -100.01 153.07 19.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -58.25 131.34 50.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.937 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -101.35 -105.96 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.552 HG23 HG13 ' A' ' 594' ' ' VAL . 3.8 t -90.49 166.68 13.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.954 0.407 . . . . 0.0 111.416 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 603' ' ' THR . . . . . 0.478 HG23 ' OD1' ' A' ' 593' ' ' ASP . 53.9 m -130.32 124.32 32.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.856 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.2 m -130.59 -177.68 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.293 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.475 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 50.6 p -142.4 -0.86 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -111.79 -144.78 9.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.669 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.6 25.1 11.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.752 0.31 . . . . 0.0 111.168 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -147.27 162.58 38.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.856 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.6 149.99 36.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.737 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 5.1 m -132.45 118.01 18.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.535 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -99.55 136.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.692 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 -172.21 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.962 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.21 -103.29 0.77 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 574' ' ' SER . 1.1 mp 57.86 177.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.027 0.442 . . . . 0.0 111.537 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -169.82 129.22 0.96 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.927 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -55.12 163.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.4 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.54 31.96 21.61 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.234 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.2 148.17 41.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.904 0.383 . . . . 0.0 111.432 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.49 140.13 38.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.515 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -134.89 130.18 35.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.315 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 38.3 p -105.39 108.33 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.149 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -99.9 160.2 14.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.272 0.558 . . . . 0.0 112.085 -178.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.3 p -154.08 136.07 14.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.814 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.564 HG23 ' HB2' ' A' ' 637' ' ' SER . 0.0 OUTLIER -99.41 151.94 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.012 0.434 . . . . 0.0 111.661 -179.346 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 8.4 mmtt -140.42 134.03 30.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.095 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.493 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -92.77 123.41 36.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -117.98 143.86 46.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.041 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -110.5 160.05 16.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.859 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.31 57.59 4.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.093 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.401 ' HB3' ' OD2' ' A' ' 628' ' ' ASP . . . -157.96 -39.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 133.44 32.35 0.39 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.732 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 557' ' ' HIS . 55.2 m-80 -122.53 100.62 7.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.784 0.326 . . . . 0.0 111.061 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.3 t -99.87 119.02 47.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.493 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 24.8 p -67.29 -173.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.979 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.563 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.97 166.4 21.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.274 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.38 142.7 32.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.564 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -74.65 175.55 7.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.044 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -60.29 150.94 28.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.592 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.87 137.57 36.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -116.94 112.31 38.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.913 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 15.2 t -89.15 109.34 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.0 144.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.84 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.845 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.135 -179.988 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.721 0.296 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.49 40.55 31.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.859 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -60.61 152.95 64.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -68.52 -169.82 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.407 2.071 . . . . 0.0 112.354 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 59.2 m -87.19 120.29 28.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.691 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.15 129.55 93.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.107 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.01 160.61 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.681 2.254 . . . . 0.0 112.173 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.0 t -145.47 163.69 33.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.309 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 59.68 34.27 22.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.715 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.643 HD21 HD22 ' A' ' 578' ' ' LEU . 2.3 tm? -62.95 119.53 9.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.258 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.41 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -147.61 152.08 37.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 111.334 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.1 p -93.78 137.76 32.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.2 p -107.49 -87.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.53 108.38 19.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.885 179.65 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -123.03 134.55 54.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.141 -179.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.453 ' HB ' ' H ' ' A' ' 573' ' ' THR . 25.5 p -108.49 -157.2 0.61 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.453 ' H ' ' HB ' ' A' ' 572' ' ' THR . 0.6 OUTLIER -91.38 -12.23 35.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.324 -179.813 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.422 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.0 p -130.62 -44.87 1.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.298 -179.772 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -101.47 170.78 7.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.03 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.476 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.3 tt -160.44 146.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 87.8 m -118.41 114.04 22.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.824 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.643 HD22 HD21 ' A' ' 566' ' ' LEU . 9.3 mt -101.69 137.76 39.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.068 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 24.5 p -125.59 143.84 50.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.437 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.472 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -155.32 169.72 23.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.365 . . . . 0.0 111.124 -179.704 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.63 139.26 32.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.36 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.63 179.17 2.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.217 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 t -80.92 138.61 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 53.3 p -74.07 -1.14 18.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.657 ' HB3' HG22 ' A' ' 587' ' ' VAL . 0.8 OUTLIER -105.34 -67.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.809 179.868 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 46.7 t30 56.79 24.24 8.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 585' ' ' ASP . 2.3 m -89.29 27.06 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.039 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . 167.34 -9.33 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.41 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 3.6 t -66.46 153.65 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -52.17 0.76 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.419 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.665 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -134.98 179.9 17.18 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.813 -179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -134.75 121.62 20.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.614 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -100.89 126.2 47.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.6 179.757 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.66 142.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.924 0.393 . . . . 0.0 111.266 -179.495 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.577 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 81.0 m-85 -106.0 151.73 24.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.317 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -140.7 97.19 3.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.039 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 56.9 71.59 0.71 Allowed Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.627 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.2 p 47.62 31.07 1.93 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.813 0.339 . . . . 0.0 111.571 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.99 110.3 2.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.775 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.614 HD11 ' HB3' ' A' ' 593' ' ' ASP . 1.6 tt -52.22 133.92 33.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.332 -179.647 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.98 -100.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.868 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.468 ' O ' HG13 ' A' ' 594' ' ' VAL . 14.4 t -90.84 167.53 12.38 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.201 0.524 . . . . 0.0 111.436 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.6 m -135.33 117.24 15.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.522 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 609' ' ' ALA . 18.6 m -117.65 -172.55 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.636 -179.437 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.665 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 6.1 p -143.23 -2.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.14 -117.66 4.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.479 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -16.77 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.696 0.284 . . . . 0.0 111.315 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.487 ' O ' HG11 ' A' ' 604' ' ' VAL . 74.5 p -108.02 167.87 9.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.942 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.681 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.32 128.23 10.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.046 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.4 m -108.66 119.51 39.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.272 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.476 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.5 mp -108.48 138.21 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.3 p -121.13 175.59 6.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.898 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.09 61.51 5.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.667 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 574' ' ' SER . 9.5 mt -131.2 124.78 31.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 110.816 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -77.5 140.21 39.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.98 164.55 26.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.167 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.06 44.59 25.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.057 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.6 m -139.98 149.78 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -86.17 134.65 33.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.549 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -132.75 152.77 51.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.215 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -137.75 104.68 5.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.202 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.514 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 78.5 m-85 -100.52 176.49 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.292 0.568 . . . . 0.0 112.12 -178.927 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -173.73 168.72 4.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.71 179.641 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.472 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -131.16 151.36 35.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.068 0.461 . . . . 0.0 111.634 -179.899 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.531 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 8.9 mmtt -140.7 123.24 16.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.151 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.46 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -79.42 132.88 36.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.096 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -119.97 144.99 47.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.779 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -107.57 166.83 10.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.127 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.24 34.65 0.74 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.191 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.517 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -140.11 4.74 2.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.058 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.93 30.99 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.773 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -114.84 124.74 52.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.665 0.269 . . . . 0.0 110.788 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 12.4 p -116.45 134.53 59.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 111.244 179.928 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.46 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 21.4 p -76.89 -166.11 0.64 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.707 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.691 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -87.69 173.03 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.895 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.531 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -86.49 133.88 33.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.2 -179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.463 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -63.46 178.74 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.922 179.783 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.01 149.23 19.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.384 179.601 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.64 129.0 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.429 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.514 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.9 p -108.38 140.73 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.95 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.52 102.87 12.23 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.396 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 47.2 t -99.31 114.33 37.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.248 -179.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.07 101.07 10.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.613 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 68.3 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.201 -179.822 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 10.9 p80 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.856 0.36 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.7 -162.83 0.82 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.882 -179.903 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -60.58 146.48 85.39 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.002 -179.921 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.32 -159.72 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.457 2.105 . . . . 0.0 112.101 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.1 134.59 52.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.208 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.56 128.82 93.85 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.483 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 83.3 Cg_exo -45.23 136.65 10.88 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.697 2.265 . . . . 0.0 112.074 179.578 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.9 p -119.05 149.67 41.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.7 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 10.0 m120 55.94 61.96 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.483 179.468 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.52 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 33.1 tp -65.71 159.17 25.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.298 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.52 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.03 177.24 10.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.035 0.445 . . . . 0.0 111.636 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 568' ' ' SER . . . . . 0.468 ' HB2' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -133.6 150.74 51.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.465 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -120.52 -90.35 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.447 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.0 97.26 11.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.229 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.468 ' NE2' ' HB2' ' A' ' 568' ' ' SER . 1.5 mp0 -113.72 102.71 10.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.828 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 8.6 p -88.17 -162.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.239 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.65 19.0 7.89 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.661 -179.569 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 8.9 p -158.89 -44.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.79 0.329 . . . . 0.0 111.204 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 65.3 p -113.92 122.2 46.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.425 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.1 tt -109.17 138.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.168 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 14.3 m -112.9 116.11 29.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' A' ' 568' ' ' SER . 59.5 mt -103.73 156.5 17.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.947 0.403 . . . . 0.0 111.182 -179.702 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.1 p -145.0 138.91 27.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.04 179.666 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -144.8 169.83 17.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.971 0.415 . . . . 0.0 111.52 -179.34 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -80.53 126.65 31.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.144 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.21 163.4 4.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.6 t -88.08 133.06 34.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -8.16 37.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.183 179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.1 54.98 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.958 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -71.15 -135.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.674 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.1 t 52.6 20.6 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 121.119 0.485 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -171.1 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.851 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 57.8 t -65.25 117.55 6.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.764 0.316 . . . . 0.0 110.422 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.0 t -101.06 -35.41 9.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.56 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -158.03 178.44 34.31 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.216 -0.992 . . . . 0.0 113.223 -179.616 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -124.94 155.13 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.763 0.315 . . . . 0.0 110.857 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -131.39 117.8 19.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.422 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.446 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.68 143.81 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.916 0.388 . . . . 0.0 111.289 -179.575 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.56 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 92.1 m-85 -108.97 156.2 19.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.45 -179.618 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -118.19 84.04 2.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.152 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.51 -51.43 4.4 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.209 -179.614 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.11 -43.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 0.0 111.125 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -80.06 172.39 13.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.2 tp -90.79 126.98 36.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.322 179.198 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.43 -107.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.859 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.413 HG22 HG13 ' A' ' 611' ' ' ILE . 2.9 t -91.54 164.95 13.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.216 0.532 . . . . 0.0 111.495 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -131.06 106.74 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.332 179.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.694 HG11 ' HA ' ' A' ' 609' ' ' ALA . 34.6 m -111.15 -177.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.638 -179.206 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.56 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.5 p -137.47 -20.08 1.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.795 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -81.15 -116.04 0.37 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.719 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.63 -5.12 2.88 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 -179.653 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.7 p -122.2 156.86 32.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.694 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -134.53 129.74 35.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.4 m -110.02 125.99 53.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.188 -179.865 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.9 mp -111.04 136.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.955 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 82.2 p -113.88 178.0 4.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.24 36.19 92.91 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.447 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.7 OUTLIER -87.88 -174.23 4.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 110.992 -179.903 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -147.29 158.04 43.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -88.91 157.32 18.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.213 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.66 43.37 28.22 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.089 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 10.7 m -140.31 144.13 36.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.457 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.9 p -90.58 140.48 29.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.262 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -135.12 122.66 22.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.828 0.347 . . . . 0.0 111.711 -179.5 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -102.88 105.51 15.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.91 178.852 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.409 ' O ' HG23 ' A' ' 623' ' ' THR . 74.1 m-85 -100.17 176.38 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.399 0.618 . . . . 0.0 112.442 -178.684 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -170.18 155.5 5.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.619 179.669 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.483 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -119.45 159.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.932 0.396 . . . . 0.0 111.538 -179.743 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.571 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.2 mmtt -140.75 113.34 8.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.211 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 633' ' ' VAL . . . -79.51 119.39 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.52 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.418 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -117.83 166.43 12.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.784 179.817 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.15 164.23 20.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.61 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.63 57.38 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.97 -19.02 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.082 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 113.09 26.15 4.18 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.269 -179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.477 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 4.4 m120 -121.81 121.25 36.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.748 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 626' ' ' ALA . 2.3 p -138.91 134.59 42.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.225 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.19 -176.5 3.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.828 179.908 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.472 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -74.68 176.17 7.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.044 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.571 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -73.54 154.72 39.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.078 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.411 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.3 p -79.85 -163.27 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.758 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.79 146.99 41.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.98 23.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.928 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.5 p -102.9 134.53 43.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.262 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.5 m -109.32 105.92 15.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.337 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.24 130.32 63.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.581 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -96.45 121.66 38.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.102 -179.75 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 33.5 p-80 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.595 0.236 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 5.8 ttm 64.79 135.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.405 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.464 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -70.94 152.39 94.99 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.108 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.22 -165.76 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.642 2.228 . . . . 0.0 112.237 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.33 150.69 19.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.765 179.631 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.595 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -84.11 125.95 71.19 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.416 -179.748 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -48.31 154.57 2.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.686 2.257 . . . . 0.0 112.009 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.26 163.08 33.95 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.07 0.462 . . . . 0.0 111.664 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.94 52.74 11.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.06 179.122 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.675 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 2.0 tp -74.23 156.95 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.051 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.675 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 -177.99 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.518 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 83.9 p -133.76 129.04 36.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.653 179.828 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 76.1 p -111.43 -72.53 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.383 -179.81 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.26 96.3 10.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.351 . . . . 0.0 110.905 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 576' ' ' ILE . 0.7 OUTLIER -123.39 105.64 9.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 17.0 p -85.69 -155.2 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.919 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.0 m -88.04 -37.34 16.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 16.0 p -115.0 -2.61 12.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.669 0.271 . . . . 0.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -133.99 165.41 25.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.954 179.969 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 571' ' ' GLN . 16.4 tt -160.06 148.71 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.526 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.9 m -132.66 124.03 27.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.659 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' A' ' 608' ' ' THR . 23.7 mt -107.47 153.28 23.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.398 . . . . 0.0 111.486 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.7 t -133.38 135.23 44.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.051 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.528 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -143.48 169.89 16.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.473 -179.268 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 m -82.05 115.87 21.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.213 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 582' ' ' ALA . . . . . 0.429 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -62.55 157.25 20.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.018 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.6 146.29 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.757 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 74.5 p -82.56 20.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.126 179.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.17 71.32 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.94 22.25 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -85.45 6.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -155.85 -25.67 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.401 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.8 t -66.26 140.53 19.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.83 0.348 . . . . 0.0 111.173 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 22.3 p -115.48 -51.49 2.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.17 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.564 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -144.24 179.55 21.45 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.597 -179.947 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -131.28 120.36 23.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 111.016 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.521 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -99.75 122.17 42.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.419 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -102.01 138.17 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.971 0.415 . . . . 0.0 111.267 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.719 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 96.1 m-85 -99.27 162.04 13.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.655 179.912 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -140.32 88.96 2.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 62.55 69.02 1.42 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.995 -179.463 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p 50.23 35.02 9.59 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.008 0.432 . . . . 0.0 111.115 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.31 102.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.775 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.71 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -48.87 122.99 6.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.291 -179.654 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -92.89 -98.95 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.198 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.8 169.07 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.133 0.492 . . . . 0.0 111.669 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.16 109.07 6.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.455 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.731 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -108.42 -170.59 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.789 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.564 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 32.0 p -140.51 2.47 1.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.834 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.1 -134.05 5.56 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.475 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.429 HG22 ' HB2' ' A' ' 582' ' ' ALA . 52.5 p -112.5 -4.03 14.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.768 0.318 . . . . 0.0 111.238 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.518 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.4 p -119.1 152.75 35.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.122 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.731 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.26 124.02 22.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 9.2 m -106.56 134.41 49.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.347 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.445 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.4 mp -121.01 138.6 50.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 14.1 m -117.76 162.36 18.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.793 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.49 79.1 0.22 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.321 -179.761 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 614' ' ' LEU . 1.2 tp -135.18 154.86 51.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 111.081 -179.755 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -92.05 163.36 14.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.059 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -89.52 156.9 18.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.912 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 2.6 p30 40.57 58.09 2.44 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.504 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 618' ' ' THR . . . . . 0.446 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 3.6 m -134.29 148.68 50.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.077 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 78.9 p -87.06 130.21 34.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.746 179.845 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 620' ' ' TYR . . . . . 0.446 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 69.5 m-85 -134.63 135.21 41.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.959 0.409 . . . . 0.0 111.645 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 43.3 p -114.62 128.13 56.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.857 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.483 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 76.2 m-85 -120.08 168.94 10.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.458 0.647 . . . . 0.0 112.274 -178.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -167.42 152.67 7.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.314 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.56 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -118.97 155.86 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 112.266 -179.266 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.719 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 5.7 mmtp -140.77 142.68 34.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.757 -179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.54 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -101.33 128.2 47.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.489 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.52 140.29 50.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 179.65 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.61 167.99 9.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.75 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -66.36 -31.32 72.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.89 -179.265 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.2 10.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.569 -179.38 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 76.81 69.82 1.35 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.508 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 71.6 m-80 -148.2 124.04 10.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.685 0.278 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 25.7 m -112.59 139.44 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.044 0.45 . . . . 0.0 111.693 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.54 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 2.0 p -83.8 -164.93 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.248 179.592 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.595 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.94 161.33 23.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.73 0.3 . . . . 0.0 110.814 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.639 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -74.1 144.23 45.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.865 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.416 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -72.15 -163.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.19 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.27 142.09 34.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.844 179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.483 ' HA ' ' O ' ' A' ' 622' ' ' PHE . . . -79.65 116.22 19.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.065 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 621' ' ' THR . 11.6 p -101.03 131.82 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.129 -179.942 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 45.8 t -106.28 113.78 27.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.1 147.75 26.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.432 -179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -111.46 116.07 30.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.856 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.183 179.967 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.603 0.239 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 12.3 mmt 67.14 -75.2 0.06 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.2 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -48.24 134.49 12.38 Favored Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.359 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -83.34 -158.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.731 2.288 . . . . 0.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 3.4 m -115.91 133.94 55.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.067 179.856 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.54 127.33 92.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.247 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.36 163.63 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.737 2.292 . . . . 0.0 112.003 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.2 t -155.07 158.43 39.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.366 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.2 m120 58.36 49.63 10.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.287 179.715 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.797 HD11 ' HG ' ' A' ' 578' ' ' LEU . 6.1 tp -71.16 158.49 36.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.306 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.641 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 174.51 13.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 0.0 111.475 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.9 142.8 50.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.619 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.13 -78.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.277 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 570' ' ' ALA . . . . . 0.532 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -88.67 96.53 10.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.186 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -115.03 97.6 6.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.92 179.873 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 61.1 p -92.63 -163.61 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 46.2 p -90.52 24.97 2.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.353 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 614' ' ' LEU . 24.9 p -163.83 -49.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.017 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -101.06 160.14 14.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.945 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.458 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.5 tt -151.18 137.08 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.926 0.394 . . . . 0.0 111.176 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 577' ' ' THR . . . . . 0.532 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.8 m -106.17 131.36 53.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.567 179.63 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.797 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -120.81 128.24 52.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.532 -179.208 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.6 t -123.73 128.34 49.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.405 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.599 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.6 p90 -140.64 170.21 16.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.959 0.409 . . . . 0.0 111.456 -179.355 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.3 m -79.6 123.02 27.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.143 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.58 162.63 8.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.22 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 7.4 m -71.46 158.2 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 17.45 3.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.614 ' O ' HG23 ' A' ' 589' ' ' VAL . 1.6 t70 -138.5 44.22 2.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.799 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -60.79 -12.87 12.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.162 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.7 -9.92 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.041 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.0 -29.82 0.6 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.569 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 585' ' ' ASP . 7.4 t -65.31 145.48 13.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.644 0.259 . . . . 0.0 110.874 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.4 t -117.64 -34.32 4.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.477 -179.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.716 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -157.46 169.43 34.4 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.16 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -122.63 126.15 47.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.727 0.298 . . . . 0.0 110.763 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 1.3 m-20 -101.54 116.62 33.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.632 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.62 HG13 ' HB ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.32 139.95 19.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.982 0.42 . . . . 0.0 111.106 -179.599 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -102.21 146.58 27.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.278 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 0.2 OUTLIER -101.67 84.59 2.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.179 179.105 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.13 -55.82 4.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.349 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.5 p -147.56 -56.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.774 0.321 . . . . 0.0 111.033 179.86 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.69 174.12 11.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 154.15 25.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.906 0.384 . . . . 0.0 110.986 -179.944 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -141.08 -68.68 0.39 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.135 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.62 ' HB ' HG13 ' A' ' 594' ' ' VAL . 0.1 OUTLIER -90.76 154.88 19.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.133 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.23 89.34 2.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.423 178.699 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.808 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.9 m -104.03 -176.03 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.613 -179.322 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.716 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.6 p -144.41 -11.56 0.62 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.111 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -96.91 -137.67 9.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.628 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.89 10.05 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.641 0.258 . . . . 0.0 111.396 -179.828 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -137.11 165.55 25.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.315 -179.902 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.808 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -141.8 150.91 42.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.158 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.6 m -134.43 118.33 17.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.303 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.458 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.5 mp -117.88 111.81 35.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.0 154.01 21.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.988 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.64 33.64 5.53 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.601 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 574' ' ' SER . 3.6 mt -107.58 155.8 19.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.783 0.325 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.68 159.97 15.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.95 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.02 179.58 5.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.401 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.18 28.39 17.68 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.077 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.15 150.47 44.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.468 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 75.3 m -100.64 121.08 41.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.29 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -114.46 129.39 56.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.993 0.425 . . . . 0.0 111.897 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.5 OUTLIER -108.75 121.91 46.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.787 178.907 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.23 165.15 12.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.381 0.61 . . . . 0.0 112.395 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 7.0 p -150.44 149.99 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.709 179.27 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.599 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -117.01 152.78 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.955 0.407 . . . . 0.0 111.523 -179.769 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.7 mttt -140.62 139.79 34.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.204 -179.654 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -99.04 121.96 41.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.449 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.84 140.46 49.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.987 -179.813 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 628' ' ' ASP . . . . . 0.446 ' OD1' HG22 ' A' ' 589' ' ' VAL . 9.1 m-20 -105.2 175.01 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.893 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.95 15.29 4.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.293 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -113.26 6.45 17.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.976 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 80.11 9.9 86.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.475 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -102.14 125.38 48.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.89 137.94 56.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.093 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.1 -167.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.163 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.08 178.9 7.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.061 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.483 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.2 146.86 23.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.05 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.422 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.1 t -79.09 174.71 11.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -59.3 148.29 32.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.801 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -81.3 126.67 31.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.575 ' O ' ' HA ' ' A' ' 621' ' ' THR . 5.3 p -99.5 134.11 39.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.554 179.702 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.87 113.34 26.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 111.056 -179.398 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.409 HG21 ' CD1' ' A' ' 576' ' ' ILE . 0.4 OUTLIER -122.95 131.34 73.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.901 179.826 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.39 113.99 25.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.2 -179.93 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 557' ' ' HIS . . . . . 0.41 ' N ' ' HD1' ' A' ' 557' ' ' HIS . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.699 0.285 . . . . 0.0 111.202 . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -126.09 -48.35 1.61 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.003 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -63.54 151.95 86.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.014 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -68.5 -172.66 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.527 2.151 . . . . 0.0 112.311 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 18.2 p -99.93 135.45 41.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.405 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.419 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -64.12 132.24 95.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.128 179.769 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB2' ' HB2' ' A' ' 637' ' ' SER . 81.0 Cg_exo -45.47 153.74 0.63 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.616 2.21 . . . . 0.0 112.226 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.29 151.05 44.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.943 0.401 . . . . 0.0 111.62 -179.577 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 59.39 59.71 2.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.969 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.715 HD11 ' HG ' ' A' ' 578' ' ' LEU . 63.9 tp -74.83 159.95 31.28 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.891 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.417 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.34 173.35 15.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.021 0.438 . . . . 0.0 111.934 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.71 129.11 36.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.307 179.381 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.8 p -106.36 -84.23 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 111.643 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.8 96.92 10.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.461 -179.426 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.446 ' NE2' HG13 ' A' ' 642' ' ' VAL . 0.2 OUTLIER -116.0 101.65 8.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.793 179.752 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.5 p -90.78 -157.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.072 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 40.5 p -95.24 25.21 4.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.465 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 78.8 p -167.36 -50.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.278 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.55 131.54 53.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.146 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.64 HD12 HG11 ' A' ' 642' ' ' VAL . 10.0 tt -121.99 143.31 35.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -107.15 117.01 32.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.579 179.662 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -108.63 134.99 50.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.149 -179.526 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -130.01 136.52 49.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.474 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.1 p90 -148.59 169.78 19.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.902 0.382 . . . . 0.0 111.122 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 5.5 m -82.14 116.52 21.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.963 179.684 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.25 155.25 21.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.048 179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 m -59.46 120.61 9.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.79 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -15.96 61.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.9 -66.14 0.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.865 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.484 ' O ' HG12 ' A' ' 587' ' ' VAL . 49.5 t30 57.71 -133.69 1.19 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.772 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.484 HG12 ' O ' ' A' ' 586' ' ' ASN . 3.8 p 45.1 23.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 111.655 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.44 -21.13 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.084 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.7 t -76.34 134.18 29.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.789 0.328 . . . . 0.0 110.713 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.89 -48.22 4.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.314 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.12 -179.35 26.77 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.87 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -126.42 132.5 51.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.36 123.19 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.389 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.86 137.57 26.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.889 0.376 . . . . 0.0 111.228 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.413 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 93.0 m-85 -99.47 145.39 27.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.513 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 12.7 t30 -114.92 89.74 3.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.368 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.56 -70.9 3.02 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.129 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.5 p -148.11 -16.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.865 0.364 . . . . 0.0 110.888 179.73 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -115.53 134.75 54.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 179.602 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.403 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -48.35 147.67 2.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.345 -179.747 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.513 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -115.33 -106.65 0.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.173 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.5 t -90.92 168.07 11.96 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.205 0.526 . . . . 0.0 111.854 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -128.92 130.84 47.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.313 179.756 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.6 m -132.77 -177.7 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.501 -179.365 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.521 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 34.7 p -145.53 17.67 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.974 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -128.05 -121.85 2.44 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.761 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.95 9.3 5.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.627 0.251 . . . . 0.0 111.41 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.1 p -139.72 140.08 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.36 -179.879 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -122.48 148.0 45.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.5 m -122.01 109.08 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.278 -179.896 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.462 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -102.34 126.71 56.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.096 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 164.97 13.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.864 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.85 47.78 5.18 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.473 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.5 mt -119.38 152.25 37.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 110.918 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.7 152.12 35.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.151 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -77.93 174.91 10.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.4 t0 56.86 25.55 10.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.14 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.72 161.57 32.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.054 179.827 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 47.5 t -121.94 137.28 54.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.82 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -135.62 172.54 12.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.943 0.401 . . . . 0.0 111.491 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.55 110.65 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.105 179.496 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.408 ' O ' HG23 ' A' ' 623' ' ' THR . 78.6 m-85 -99.73 165.65 11.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.227 0.537 . . . . 0.0 111.959 -178.928 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.408 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.8 OUTLIER -159.62 153.07 22.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.882 179.628 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.474 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -118.57 150.12 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.924 0.392 . . . . 0.0 111.345 -179.763 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.413 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.3 mttt -136.0 150.16 49.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.083 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -106.26 129.27 54.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.223 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.637 ' HB3' HG12 ' A' ' 633' ' ' VAL . 1.9 ptmm? -127.78 142.62 51.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.28 169.72 8.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 179.848 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.62 48.7 1.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.74 3.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.084 179.934 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.84 61.81 1.74 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.458 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.8 m120 -145.48 106.98 4.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.646 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 633' ' ' VAL . . . . . 0.637 HG12 ' HB3' ' A' ' 627' ' ' LYS . 29.4 m -118.82 137.98 51.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.378 -179.823 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.419 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -87.95 -167.0 1.74 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.718 179.808 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -73.0 170.95 13.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.14 138.78 33.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.465 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.51 179.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.234 -179.847 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.24 148.44 27.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.69 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.97 128.39 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.003 -179.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.3 m -109.73 115.08 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.268 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 19.6 m -79.81 100.95 8.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.287 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.64 HG11 HD12 ' A' ' 576' ' ' ILE . 63.6 t -99.86 108.79 23.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.37 -179.458 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 95.0 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 19.8 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.18 -179.902 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.715 0.293 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 11.8 mtm 56.56 23.75 7.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.073 179.893 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -89.46 152.64 47.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.222 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.45 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.562 2.175 . . . . 0.0 111.958 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.831 HG23 ' HB2' ' A' ' 585' ' ' ASP . 2.2 p -107.52 136.88 46.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.889 0.376 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.423 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -67.18 129.9 93.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.305 -179.783 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.458 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 85.3 Cg_exo -47.28 152.48 2.21 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.729 2.286 . . . . 0.0 111.854 179.277 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.96 161.76 34.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.34 -179.652 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 61.1 34.05 19.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.938 179.639 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.779 HD21 HD22 ' A' ' 578' ' ' LEU . 1.6 tm? -69.15 117.51 10.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.117 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.494 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -144.74 145.97 31.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.232 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 2.1 p -84.83 150.74 24.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 179.92 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 6.2 p -124.29 -86.43 0.63 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.277 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.9 99.46 12.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.014 -179.926 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.485 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.6 tt0 -119.43 140.13 50.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.043 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 36.5 p -128.45 -167.85 1.83 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.895 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 6.1 p -87.38 32.98 0.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.189 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 23.2 p -169.46 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.315 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -110.69 135.97 50.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.248 -179.677 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.485 HD12 ' HG3' ' A' ' 571' ' ' GLN . 13.8 tt -127.71 139.32 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.78 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 20.7 m -110.27 122.2 47.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.135 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.779 HD22 HD21 ' A' ' 566' ' ' LEU . 13.1 mt -109.1 141.47 41.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.969 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.5 t -132.29 133.54 44.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.559 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -144.76 169.66 17.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.198 -179.599 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.7 m -84.69 128.25 34.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.199 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.24 25.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.047 179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 94.5 p -61.49 150.19 36.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.899 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 30.7 p -85.61 11.64 10.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.01 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.831 ' HB2' HG23 ' A' ' 561' ' ' THR . 0.4 OUTLIER -119.38 45.08 2.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.923 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.44 ' C ' ' H ' ' A' ' 588' ' ' GLY . 73.1 m-20 -65.11 -164.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.962 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 11.2 t 66.41 -4.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.118 0.485 . . . . 0.0 110.906 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 588' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -142.24 -16.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 585' ' ' ASP . 89.3 t -82.49 146.57 6.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.67 0.272 . . . . 0.0 110.781 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 590' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 591' ' ' GLY . 1.3 t -106.08 -54.41 2.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.638 -179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -151.71 -172.21 20.28 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.137 -179.563 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -131.01 129.26 41.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.791 0.329 . . . . 0.0 110.586 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.18 117.67 34.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.548 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.83 137.01 28.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.804 -179.892 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 33.9 m-85 -101.9 175.06 5.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.315 -179.444 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.44 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 18.2 t30 -140.48 89.3 2.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.737 179.666 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 85.32 -68.84 3.38 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.305 -179.736 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.406 ' H ' ' H ' ' A' ' 599' ' ' ALA . 1.1 p -150.3 -18.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.902 0.382 . . . . 0.0 110.638 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.406 ' H ' ' H ' ' A' ' 598' ' ' THR . . . -114.6 135.25 54.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.6 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.1 tp -51.94 144.22 12.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.218 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.44 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -110.96 -98.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.101 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.548 HG23 HG13 ' A' ' 594' ' ' VAL . 2.9 t -90.83 160.2 15.87 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.108 0.48 . . . . 0.0 111.645 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 15.9 m -125.97 122.62 36.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.167 179.551 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.755 HG11 ' HA ' ' A' ' 609' ' ' ALA . 30.1 m -127.83 -174.74 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.062 0.458 . . . . 0.0 111.998 -178.918 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.523 HG22 ' HA3' ' A' ' 591' ' ' GLY . 6.2 p -146.59 -2.29 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.889 179.843 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.49 -134.15 6.64 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.717 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.47 30.16 7.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.776 0.322 . . . . 0.0 111.242 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.489 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -157.77 141.17 15.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.215 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.755 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.78 155.97 36.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.81 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 16.6 m -137.06 124.51 22.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.241 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.449 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 4.7 mp -113.68 128.34 70.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.96 171.08 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 61.02 64.81 3.74 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.675 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.4 OUTLIER -115.51 132.44 56.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.828 0.347 . . . . 0.0 110.868 -179.989 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -99.44 134.72 41.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.116 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.12 168.23 16.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 16.2 t0 59.66 29.08 18.63 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.019 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.9 m -134.79 142.23 46.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.168 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 26.3 t -84.09 143.66 29.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.738 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 620' ' ' TYR . . . . . 0.415 ' HB2' HG23 ' A' ' 642' ' ' VAL . 59.8 m-85 -136.87 142.35 42.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.151 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.4 p -132.57 114.2 13.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.289 179.447 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.546 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 81.3 m-85 -109.13 166.88 10.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.283 0.563 . . . . 0.0 111.905 -179.203 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 623' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.2 OUTLIER -169.26 127.17 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.693 179.603 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.526 HG23 ' HG ' ' A' ' 566' ' ' LEU . 0.6 OUTLIER -99.36 149.55 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.491 . . . . 0.0 111.926 -179.056 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.1 mttt -128.24 166.36 18.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.332 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -116.06 123.78 48.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -121.38 154.44 36.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.829 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 171.74 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.57 47.69 1.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.361 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -153.92 -30.85 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.056 179.86 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 125.11 28.25 1.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.573 179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -112.7 120.29 41.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.77 0.319 . . . . 0.0 110.702 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.7 147.75 24.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.33 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.3 t -89.95 -154.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.524 179.68 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.423 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -84.0 -179.5 7.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 179.725 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.548 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.15 140.3 29.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.371 . . . . 0.0 111.023 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.458 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 4.9 p -68.45 -172.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.014 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.71 145.37 52.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.747 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.421 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -80.17 119.19 22.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.167 -179.902 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.3 p -101.12 123.95 54.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.041 179.855 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.3 t -105.58 106.14 16.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.862 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 620' ' ' TYR . 0.1 OUTLIER -113.36 125.45 70.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.259 179.991 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.92 101.68 12.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 70.9 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.254 -179.963 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 17.7 m80 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.857 0.36 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 9.3 mmt -112.46 -62.82 1.52 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.082 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.472 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -56.47 148.08 46.18 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.406 -179.756 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.506 ' HB3' HG22 ' A' ' 589' ' ' VAL . 69.1 Cg_endo -74.09 -168.74 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.512 2.141 . . . . 0.0 111.817 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.765 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 70.2 m -109.81 113.27 25.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.173 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.33 64.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.737 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 86.4 Cg_exo -46.98 160.33 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.602 2.201 . . . . 0.0 112.381 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.8 t -155.28 157.81 37.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.555 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 11.3 t30 58.46 43.16 19.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.432 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.759 HD11 ' HG ' ' A' ' 578' ' ' LEU . 51.7 tp -61.45 160.58 10.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.303 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.441 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.21 173.7 14.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 111.774 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.6 p -126.13 136.31 52.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.6 p -110.65 -86.88 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.534 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.16 98.5 11.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.819 0.342 . . . . 0.0 111.348 -179.76 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.409 ' HB3' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.12 104.09 10.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.844 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.8 p -103.83 -170.08 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 71.5 p -91.74 41.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.6 p -168.65 -42.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.259 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -135.28 137.47 42.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.136 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.594 HG22 ' HB ' ' A' ' 611' ' ' ILE . 13.7 tt -118.67 142.48 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.247 179.931 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.5 m -110.82 121.63 45.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.622 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.759 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -111.36 136.08 51.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.085 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.3 t -130.94 135.38 47.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.613 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.4 p90 -143.71 170.18 16.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.985 0.421 . . . . 0.0 111.428 -179.334 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.45 116.65 19.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.019 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 582' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -60.74 170.06 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.266 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.765 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 2.6 p -88.33 138.91 31.02 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.996 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -13.94 62.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.337 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 589' ' ' VAL . 27.9 m-20 -110.03 59.23 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.846 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -78.24 5.2 10.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.2 p -67.57 -18.98 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.799 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -120.79 -24.98 2.43 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 179.901 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 560' ' ' PRO . 3.5 t -69.6 133.85 31.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.906 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.9 t -120.28 0.52 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.439 -179.665 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.644 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.63 162.81 23.61 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.253 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -122.05 145.56 48.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.811 0.338 . . . . 0.0 110.746 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.581 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -123.03 124.54 43.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.723 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.553 ' CG1' HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -101.18 132.6 46.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.035 0.445 . . . . 0.0 111.032 -179.942 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.743 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 97.3 m-85 -99.74 149.31 23.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.954 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -131.35 100.4 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.757 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.9 69.52 1.24 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.332 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 68.1 p 48.41 29.51 2.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.925 0.393 . . . . 0.0 111.353 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -154.8 103.75 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.599 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.743 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -48.47 139.4 9.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.526 -179.451 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.38 -94.65 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.792 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.553 HG23 ' CG1' ' A' ' 594' ' ' VAL . 0.9 OUTLIER -91.07 163.13 14.41 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.111 0.481 . . . . 0.0 111.443 179.83 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 99.57 4.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.421 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.73 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.2 m -103.16 -167.88 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.648 -179.203 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.644 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.0 p -143.51 -24.03 0.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.014 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -83.33 -124.6 0.98 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.618 -179.921 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 0.5 OUTLIER -126.21 9.54 7.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 111.12 -179.875 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.551 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -131.19 157.63 42.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.246 -179.998 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.73 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.46 142.7 30.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.583 179.936 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.5 OUTLIER -125.24 131.2 53.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.557 -179.697 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.594 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.2 mp -115.83 130.39 70.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.131 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 3.2 p -99.37 -178.07 3.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.783 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 56.44 45.7 88.84 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.37 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 614' ' ' LEU . 6.1 tp -97.66 148.06 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 111.133 -179.769 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.74 165.55 13.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 174.04 7.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.362 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 43.32 44.04 4.49 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.946 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.16 151.55 45.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.281 179.53 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -108.63 132.54 53.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.536 179.618 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -126.6 136.87 53.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.91 0.386 . . . . 0.0 111.411 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.37 116.26 31.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.087 179.094 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -114.0 163.6 14.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.255 0.55 . . . . 0.0 112.233 -178.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -155.72 147.18 22.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.645 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.613 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -109.95 152.65 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -179.625 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.565 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 4.9 mmtt -135.79 145.68 46.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.089 -179.531 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.484 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -109.98 115.68 30.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.435 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 2.0 pttm -117.95 152.1 36.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.111 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -99.74 -159.3 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -51.56 -76.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.071 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.86 48.51 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.466 179.954 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -148.18 -66.06 0.01 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.42 -179.726 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 7.8 m120 -89.89 145.11 25.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.205 0.526 . . . . 0.0 111.811 -179.091 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.2 t -137.95 135.74 45.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 179.35 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 626' ' ' ALA . 0.6 OUTLIER -89.15 173.88 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.178 -179.513 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.444 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -82.39 171.65 13.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.212 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.484 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.14 143.36 32.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.1 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -174.45 3.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -70.55 152.0 44.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.562 179.744 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.71 149.42 29.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.026 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.12 111.05 23.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.373 -179.888 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.0 t -89.29 112.57 23.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.68 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.28 140.52 31.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.09 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.34 100.79 10.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.845 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.102 179.977 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.609 0.242 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 558' ' ' MET . . . . . 0.43 ' HB3' ' H ' ' A' ' 559' ' ' ALA . 0.0 OUTLIER 57.52 -154.34 0.35 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.249 179.864 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.43 ' H ' ' HB3' ' A' ' 558' ' ' MET . . . -57.17 147.47 56.59 Favored Pre-proline 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.347 -179.761 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.418 ' HB2' ' H ' ' A' ' 561' ' ' THR . 86.9 Cg_endo -83.27 -140.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.695 2.263 . . . . 0.0 112.137 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.418 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -115.34 122.27 45.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.806 0.336 . . . . 0.0 110.853 179.661 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.16 129.88 86.55 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.282 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 87.7 Cg_exo -45.8 125.39 8.01 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.66 2.24 . . . . 0.0 111.887 179.561 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 2.8 t -109.53 149.83 29.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.637 -179.431 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 m120 57.41 78.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.796 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.513 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 36.9 tp -90.35 159.27 16.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.303 179.118 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.513 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.61 14.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.974 0.416 . . . . 0.0 111.649 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 77.6 p -124.65 143.26 50.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.326 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.31 -89.84 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.714 0.292 . . . . 0.0 111.77 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.71 103.15 11.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.602 -179.422 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.7 134.56 54.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.757 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.403 ' HB ' ' H ' ' A' ' 573' ' ' THR . 18.5 p -129.62 -161.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.793 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.403 ' H ' ' HB ' ' A' ' 572' ' ' THR . 16.7 p -96.77 27.49 3.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 88.5 p -168.65 -40.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.333 179.985 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -115.99 153.33 31.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.237 -179.651 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.4 tt -144.78 149.11 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.912 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 71.2 m -128.36 111.61 13.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 91.9 mt -100.45 141.46 33.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.102 -179.793 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 579' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 607' ' ' THR . 22.6 t -124.8 140.43 52.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.394 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.46 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 48.3 p90 -154.55 169.79 22.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.11 -179.568 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.4 m -84.55 122.38 28.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.862 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.17 160.49 3.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.147 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.2 m -56.72 158.91 4.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 32.2 p -96.97 12.79 31.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.573 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.469 ' OD2' HG23 ' A' ' 589' ' ' VAL . 5.8 p-10 -105.78 -57.98 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.143 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 586' ' ' ASN . . . . . 0.409 ' N ' ' CG ' ' A' ' 585' ' ' ASP . 0.1 OUTLIER 48.98 24.13 0.82 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.783 0.325 . . . . 0.0 111.364 179.914 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 585' ' ' ASP . 12.5 m -98.31 -2.86 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.052 0.453 . . . . 0.0 110.995 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -165.0 -8.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.844 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.469 HG23 ' OD2' ' A' ' 585' ' ' ASP . 16.4 t -65.27 128.75 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.866 0.365 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.78 -30.5 5.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.277 -179.839 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.69 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -161.67 174.26 38.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.729 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -125.98 125.79 43.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.867 0.365 . . . . 0.0 110.905 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.504 ' OD1' HD11 ' A' ' 600' ' ' LEU . 2.3 m-20 -100.03 119.11 37.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.6 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.83 135.41 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.006 0.432 . . . . 0.0 111.185 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.697 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.2 m-85 -99.88 129.71 45.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.982 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 596' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 21.7 t30 -109.93 89.16 2.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.586 179.649 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 68.45 72.34 0.83 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 27.0 p 46.66 30.04 1.07 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.952 0.406 . . . . 0.0 111.334 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.07 106.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.763 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.697 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 7.7 tt -47.1 138.81 6.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.449 -179.641 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 601' ' ' ALA . . . . . 0.429 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -114.39 -92.11 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.0 179.816 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.6 t -90.69 168.01 12.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.256 0.551 . . . . 0.0 111.676 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 43.5 m -138.61 108.5 6.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.348 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.3 m -105.86 -168.17 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.351 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.69 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.4 p -143.06 -12.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.82 -135.49 8.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.549 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 607' ' ' THR . . . . . 0.446 ' O ' ' HA ' ' A' ' 579' ' ' SER . 70.2 p -111.3 5.13 19.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.775 0.321 . . . . 0.0 111.238 -179.896 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 2.3 p -115.38 164.14 14.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.701 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -150.93 115.85 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.733 0.301 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.6 m -102.56 121.37 42.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.154 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.0 mt -120.7 121.77 66.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 -179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 80.2 p -101.01 174.6 5.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.774 179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.89 58.38 10.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.362 -179.818 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.1 OUTLIER -120.21 133.36 55.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.861 0.362 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -74.58 160.91 30.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.232 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.11 147.01 23.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 52.97 52.95 12.84 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.1 m -134.34 142.4 47.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.175 -179.791 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.8 t -79.72 137.44 37.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.45 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -139.17 134.61 33.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.476 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.459 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.84 113.48 23.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.043 179.119 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 622' ' ' PHE . . . . . 0.473 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 63.1 m-85 -108.14 160.77 15.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.355 0.598 . . . . 0.0 112.372 -178.731 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.86 130.36 8.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.834 179.557 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.48 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.1 OUTLIER -99.61 152.03 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.168 0.509 . . . . 0.0 111.724 -179.242 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.573 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 11.6 mttt -140.73 142.3 34.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.986 -179.811 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -102.19 122.92 45.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.127 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 627' ' ' LYS . . . . . 0.452 ' HD3' ' OD2' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -114.35 149.88 35.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 179.825 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -105.76 -179.17 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.2 37.14 0.89 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.864 179.77 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -144.23 6.3 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.62 16.45 70.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.457 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.49 111.59 24.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.746 0.308 . . . . 0.0 110.789 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 10.6 p -110.34 144.38 18.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.242 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.9 -162.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.012 -179.874 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.84 178.39 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.103 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.33 147.45 23.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.294 -179.818 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 637' ' ' SER . . . . . 0.435 ' CB ' HG23 ' A' ' 624' ' ' VAL . 8.2 t -78.61 -177.11 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.755 179.837 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -65.09 142.71 58.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.535 179.682 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.459 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -79.93 120.01 23.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.955 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.527 HG22 HG13 ' A' ' 642' ' ' VAL . 7.5 p -100.26 126.88 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.186 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.32 93.17 4.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.479 179.801 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.527 HG13 HG22 ' A' ' 640' ' ' VAL . 15.5 m -99.72 155.45 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.238 -179.725 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.26 118.15 33.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.768 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.081 179.945 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.1 m80 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.73 0.3 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -122.53 -61.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.696 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -65.48 149.82 96.71 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.819 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.589 ' HB3' HG22 ' A' ' 589' ' ' VAL . 27.8 Cg_endo -62.9 175.85 2.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.44 2.093 . . . . 0.0 112.243 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 561' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 583' ' ' SER . 27.1 m -83.3 135.35 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.285 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.683 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -70.23 127.16 92.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.586 -179.774 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.44 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 60.4 Cg_exo -51.45 162.01 1.65 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.831 2.354 . . . . 0.0 111.838 179.261 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 8.1 t -159.56 169.41 23.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.279 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 57.82 33.79 23.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.348 179.653 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.83 HD11 ' HG ' ' A' ' 578' ' ' LEU . 53.9 tp -60.51 158.73 11.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.316 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.451 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.42 14.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.406 . . . . 0.0 111.553 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.9 p -129.43 127.48 41.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.372 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.57 -84.18 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.722 -179.53 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.71 97.0 9.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.44 -179.591 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.433 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.5 OUTLIER -118.63 106.41 12.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.718 179.703 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 39.3 p -95.65 -156.63 0.53 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.025 179.972 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.2 p -99.34 24.15 8.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.453 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.412 ' O ' HD12 ' A' ' 614' ' ' LEU . 87.4 p -163.95 -42.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.135 -179.972 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.515 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.7 OUTLIER -119.04 128.63 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.256 -179.661 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.47 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.4 tt -119.06 146.47 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 34.6 m -112.19 131.56 55.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.594 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.83 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -117.9 146.75 43.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.267 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 579' ' ' SER . . . . . 0.487 ' O ' HD12 ' A' ' 566' ' ' LEU . 12.5 t -140.91 140.2 34.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.471 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.498 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -155.55 169.77 23.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.256 -179.596 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.9 126.17 32.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.119 179.905 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.77 5.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.157 -179.915 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 561' ' ' THR . 3.3 p -72.62 157.49 37.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.7 -2.84 58.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 45.0 m-20 -123.18 54.39 1.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 -179.99 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -74.33 1.5 11.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.427 HG23 ' H ' ' A' ' 587' ' ' VAL . 3.2 t -60.63 -14.58 9.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.318 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -135.32 -20.04 0.74 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.666 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.589 HG22 ' HB3' ' A' ' 560' ' ' PRO . 23.1 t -56.71 148.42 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.676 0.274 . . . . 0.0 110.984 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 19.6 p -130.59 -22.49 2.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.822 -179.565 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.64 179.09 40.17 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.041 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.412 ' CD2' ' HA ' ' A' ' 626' ' ' ALA . 85.9 m-85 -137.12 123.52 20.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.633 0.254 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.616 ' OD1' HD12 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -99.65 128.55 45.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.443 179.467 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.493 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -103.4 131.65 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.854 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 95.8 m-85 -99.43 150.44 22.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.651 -179.722 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -134.05 93.53 3.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.653 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.25 73.79 0.39 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.328 -179.676 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.6 p 47.97 35.93 5.62 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.875 0.369 . . . . 0.0 111.405 -179.68 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.98 104.59 1.53 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.122 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.616 HD12 ' OD1' ' A' ' 593' ' ' ASP . 2.0 tt -49.54 121.23 4.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.063 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.2 -101.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.199 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 602' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 611' ' ' ILE . 4.5 t -90.67 169.95 10.56 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.18 0.514 . . . . 0.0 111.574 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.77 113.94 12.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.362 179.761 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.706 HG11 ' HA ' ' A' ' 609' ' ' ALA . 9.9 m -113.71 -175.17 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.621 -179.172 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.535 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -145.26 7.6 1.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.807 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.38 -120.68 3.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.649 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.49 -14.53 7.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.69 0.281 . . . . 0.0 111.338 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG21 ' A' ' 604' ' ' VAL . 67.6 p -114.09 175.02 5.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.706 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -157.76 126.18 5.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.6 OUTLIER -111.47 133.48 53.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.907 0.384 . . . . 0.0 111.46 -179.66 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.4 mp -114.82 135.13 55.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -102.8 178.5 4.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 72.78 -84.75 0.56 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.427 -179.956 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.494 HD22 HG21 ' A' ' 644' ' ' THR . 5.0 mt 49.58 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 120.9 0.381 . . . . 0.0 111.625 179.348 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 615' ' ' ALA . . . . . 0.452 ' HB3' ' OH ' ' A' ' 620' ' ' TYR . . . -168.31 111.27 0.59 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.83 179.938 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -60.4 168.76 1.95 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.493 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.73 28.5 17.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.284 179.821 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.44 148.21 40.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.335 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.49 135.0 33.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.452 179.547 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 620' ' ' TYR . . . . . 0.452 ' OH ' ' HB3' ' A' ' 615' ' ' ALA . 57.6 m-85 -126.54 146.68 50.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.24 0.543 . . . . 0.0 111.981 -179.474 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.15 103.28 6.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -99.47 165.07 11.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.359 0.6 . . . . 0.0 112.031 -178.668 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.6 p -151.96 162.9 40.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 179.353 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.706 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -125.92 153.6 34.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.953 0.406 . . . . 0.0 111.548 -179.8 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.532 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.7 mmtt -140.36 124.63 17.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.047 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 626' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 592' ' ' TYR . . . -82.8 100.62 10.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.559 179.622 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.72 155.08 17.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.012 0.434 . . . . 0.0 111.163 -179.547 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.67 -156.7 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.211 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -49.56 -78.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.647 0.261 . . . . 0.0 111.263 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -161.06 48.35 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.517 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -169.62 9.25 0.05 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.755 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -152.43 131.41 12.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.262 0.531 . . . . 0.0 111.254 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.43 124.47 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.735 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 634' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 93.0 p -67.81 -164.55 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.935 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.683 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.44 169.72 10.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.994 179.781 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.4 137.7 32.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.888 179.687 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.7 p -73.56 -167.53 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.08 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -70.89 166.95 20.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.96 131.97 40.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.329 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.21 110.76 33.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.218 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 641' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 620' ' ' TYR . 0.3 OUTLIER -88.73 118.5 28.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.85 -179.937 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.19 127.46 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -90.03 106.48 18.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 644' ' ' THR . . . . . 0.494 HG21 HD22 ' A' ' 614' ' ' LEU . 29.8 p . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.219 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.81 0.338 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 66.17 0.93 1.8 Allowed 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.497 179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 559' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -82.4 149.57 61.79 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.14 179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 560' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 559' ' ' ALA . 8.6 Cg_endo -86.73 -172.31 0.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.212 2.608 . . . . 0.0 112.271 -179.954 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.74 134.02 36.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.189 179.967 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 562' ' ' ALA . . . . . 0.649 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -71.17 132.45 86.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 563' ' ' PRO . . . . . 0.515 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.9 Cg_exo -47.61 162.75 0.22 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.666 2.244 . . . . 0.0 112.214 179.64 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.7 t -156.11 161.86 40.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.37 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 58.66 49.3 10.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.472 179.837 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.807 HD11 ' HG ' ' A' ' 578' ' ' LEU . 21.7 tp -75.19 158.27 33.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.376 179.479 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 567' ' ' ALA . . . . . 0.555 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.52 178.05 9.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.924 0.393 . . . . 0.0 111.448 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.12 129.51 48.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.22 179.442 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.7 p -103.34 -88.88 0.4 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.631 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.21 100.84 13.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.776 0.322 . . . . 0.0 111.33 -179.583 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 571' ' ' GLN . . . . . 0.652 ' HB2' HG13 ' A' ' 576' ' ' ILE . 4.0 tm0? -121.94 129.11 52.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 5.4 p -115.04 -161.52 0.78 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.766 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 47.5 p -91.55 11.89 22.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.745 0.307 . . . . 0.0 111.425 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 52.2 p -145.05 -43.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.14 172.46 6.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.583 179.817 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.652 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.8 tt -160.27 139.59 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.379 . . . . 0.0 111.3 179.886 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 15.1 m -108.13 131.26 54.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.807 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -114.24 157.04 23.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.652 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 p -152.28 137.12 17.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.488 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 580' ' ' TRP . . . . . 0.536 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -156.8 169.71 24.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.961 0.41 . . . . 0.0 111.371 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.9 m -81.18 135.69 35.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.136 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.02 172.45 2.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 67.8 p -83.44 9.62 10.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.38 24.68 5.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.231 179.943 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 585' ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' ' 589' ' ' VAL . 5.6 t70 -142.75 45.79 1.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -62.6 -5.55 2.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.261 -179.836 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 5.6 p -76.02 4.19 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.14 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -150.41 -19.8 0.07 OUTLIER Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.881 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 589' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 585' ' ' ASP . 6.0 t -78.93 136.7 23.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 41.4 p -106.84 -7.49 17.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.243 -179.846 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 591' ' ' GLY . . . . . 0.666 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 167.15 -179.86 40.56 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.67 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.01 128.87 39.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 593' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.7 OUTLIER -103.25 116.76 33.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.809 179.934 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 594' ' ' VAL . . . . . 0.419 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -101.99 136.7 32.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 595' ' ' TYR . . . . . 0.408 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 47.7 m-85 -99.4 168.48 9.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.135 -179.657 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -133.05 84.75 2.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.151 179.377 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 597' ' ' GLY . . . . . 0.471 ' O ' HG23 ' A' ' 598' ' ' THR . . . 89.56 -59.86 3.67 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.093 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -161.84 -16.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 179.861 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -110.35 136.75 49.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 600' ' ' LEU . . . . . 0.464 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.3 tm? -55.45 125.44 20.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.826 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -95.82 -104.87 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.372 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.0 t -90.54 165.39 13.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.271 0.558 . . . . 0.0 111.936 -179.397 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 57.8 m -129.92 128.36 42.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.003 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 604' ' ' VAL . . . . . 0.722 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.7 m -127.8 -177.93 2.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.839 0.352 . . . . 0.0 111.713 -179.364 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 605' ' ' THR . . . . . 0.666 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 72.1 p -137.87 2.04 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.878 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -117.09 -123.11 3.38 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.424 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 2.0 p -130.6 8.78 4.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.681 0.277 . . . . 0.0 111.165 179.987 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 608' ' ' THR . . . . . 0.556 ' O ' HG11 ' A' ' 604' ' ' VAL . 40.6 p -130.19 126.18 36.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.266 -179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 609' ' ' ALA . . . . . 0.722 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -114.51 126.1 54.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.247 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 610' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.6 m -111.8 123.67 50.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 611' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -106.56 138.68 30.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.086 -179.982 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.02 163.46 15.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.823 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 67.97 68.43 1.65 Allowed Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.436 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 614' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.0 OUTLIER -123.05 152.5 40.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -97.53 155.07 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.996 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.52 161.89 15.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 55.54 38.91 30.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.008 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.13 141.45 36.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.114 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 89.9 p -87.7 131.26 34.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.721 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.366 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -106.42 118.56 36.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.29 179.249 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -111.34 165.11 12.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.21 0.529 . . . . 0.0 112.004 -179.151 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.91 136.53 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.888 179.514 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 624' ' ' VAL . . . . . 0.517 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.58 151.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 111.755 -179.297 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 625' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.7 mttt -139.81 157.65 45.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.704 -179.725 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -109.22 145.2 36.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.201 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 131.36 26.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.764 179.845 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.46 169.81 8.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.981 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.57 37.01 0.85 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.022 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -134.98 18.51 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.967 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 68.34 32.21 75.4 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.588 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 632' ' ' ASN . . . . . 0.58 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 18.7 m120 -127.57 125.12 39.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.713 0.292 . . . . 0.0 110.915 -179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -119.77 134.93 61.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.885 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 60.2 p -71.56 -170.51 0.54 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.121 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 635' ' ' ALA . . . . . 0.649 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.7 173.72 8.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.596 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 636' ' ' ALA . . . . . 0.488 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.64 134.43 34.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.971 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.3 t -73.06 -172.21 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.15 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 149.38 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -84.24 128.0 34.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 12.2 p -103.23 135.87 38.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -106.99 120.1 41.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.93 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.631 HG21 ' HG3' ' A' ' 571' ' ' GLN . 0.7 OUTLIER -122.92 127.27 74.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.95 179.957 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -96.68 103.52 15.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.184 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.671 0.272 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 589' ' ' VAL . 60.7 Cg_endo -72.49 -177.55 2.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.538 2.159 . . . . 0.0 112.436 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 69.5 p -91.98 155.78 17.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.105 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.735 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -83.08 127.03 70.86 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.447 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.3 Cg_exo -48.34 138.42 23.55 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.542 2.161 . . . . 0.0 111.683 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 52.5 p -128.28 162.47 26.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.524 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 59.38 54.38 4.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.598 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' ' 578' ' ' LEU . 65.5 tp -69.68 160.78 30.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.417 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.88 176.05 11.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.996 0.426 . . . . 0.0 111.581 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 70.8 p -136.52 122.81 20.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.461 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 7.0 p -99.42 -88.04 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.19 131.5 34.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.075 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.463 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -150.49 113.65 4.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.825 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.8 p -95.84 -153.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.99 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.2 p -97.62 22.41 9.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.9 p -166.15 -46.51 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.502 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.34 133.59 50.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.213 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 21.5 tt -124.33 153.17 30.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.043 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.7 m -122.95 121.68 36.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -105.72 149.47 26.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.452 -179.307 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . 0.461 ' O ' HD12 ' A' ' 566' ' ' LEU . 0.3 OUTLIER -137.83 143.83 41.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.112 179.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.571 ' CE2' HG11 ' A' ' 624' ' ' VAL . 47.6 p90 -158.55 169.98 23.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.924 0.392 . . . . 0.0 111.483 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.93 128.88 33.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.26 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.99 155.09 32.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.05 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 16.4 m -65.07 142.34 58.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.91 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 6.8 m -64.44 -17.49 63.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.047 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -112.75 143.57 43.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.957 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -152.33 42.55 0.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -17.47 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.186 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -152.32 -4.0 0.16 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.551 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 560' ' ' PRO . 12.1 t -64.57 149.44 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.755 0.312 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 39.7 p -124.3 -51.5 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.515 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -153.86 -171.91 21.4 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.904 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -121.52 175.7 6.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.855 0.36 . . . . 0.0 110.975 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.49 ' HB3' HD21 ' A' ' 600' ' ' LEU . 3.6 m-20 -140.21 131.92 27.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.677 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.585 ' HB ' HG22 ' A' ' 602' ' ' THR . 43.1 t -99.9 126.23 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.205 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.429 ' HB2' ' OG1' ' A' ' 623' ' ' THR . 41.3 m-85 -99.97 129.47 46.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -106.55 84.77 2.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.542 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.91 -86.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.341 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -143.63 11.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.912 0.387 . . . . 0.0 111.054 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -137.0 151.1 48.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.09 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -60.32 136.02 57.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.417 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -113.06 -101.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.497 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.585 HG22 ' HB ' ' A' ' 594' ' ' VAL . 12.2 t -88.85 176.93 6.84 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.789 0.328 . . . . 0.0 111.425 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -140.58 140.03 35.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.931 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.805 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.9 m -140.39 177.48 4.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.496 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.515 HG22 ' HA3' ' A' ' 591' ' ' GLY . 1.4 p -144.57 3.26 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.018 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.63 -132.02 6.1 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 4.71 13.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.689 0.28 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.411 ' O ' HG11 ' A' ' 604' ' ' VAL . 36.8 p -129.89 -178.98 4.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.805 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -153.78 147.8 25.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.996 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.3 m -127.76 122.43 32.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.506 HD11 HG11 ' A' ' 594' ' ' VAL . 3.5 mt -121.68 118.11 54.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.976 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -102.84 175.24 5.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.866 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.58 70.76 0.99 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.498 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.513 HD12 ' O ' ' A' ' 574' ' ' SER . 8.5 mt -136.93 122.46 19.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.762 0.315 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -73.37 143.92 46.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.29 161.4 29.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.384 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.73 44.31 26.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.283 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.1 m -140.12 152.43 46.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.321 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.2 t -89.24 134.03 34.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -137.78 122.82 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.257 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 64.0 p -103.1 124.22 48.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -119.21 162.38 18.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.104 0.478 . . . . 0.0 111.732 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.448 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 0.8 OUTLIER -155.35 179.49 9.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.258 179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.571 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -138.54 147.26 25.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.004 0.43 . . . . 0.0 111.596 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.498 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 3.2 mmtp -141.02 120.21 12.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.38 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -80.13 138.45 36.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.634 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.455 ' HG2' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -124.77 161.93 25.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.881 0.372 . . . . 0.0 111.312 -179.725 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER -123.7 155.31 38.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.661 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.34 51.66 2.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.189 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.13 3.22 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.172 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 92.28 42.87 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.55 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.45 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . 5.4 m120 -134.28 119.47 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.788 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.37 148.3 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 0.0 111.34 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 13.3 p -90.25 -165.94 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.735 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.29 176.18 6.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.714 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.498 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -89.96 146.76 24.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.044 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 6.6 p -81.15 -174.02 4.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.884 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.17 146.64 54.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.555 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 123.17 27.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.9 m -100.79 106.88 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.98 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.55 95.03 8.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.955 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.38 136.36 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.081 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.33 114.54 28.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.79 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.201 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.675 0.274 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.76 -159.86 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.668 2.245 . . . . 0.0 112.467 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 138.94 50.41 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.104 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.98 132.3 86.73 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.23 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.452 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.2 Cg_exo -45.75 155.91 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.77 2.313 . . . . 0.0 112.116 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 70.2 p -136.52 149.96 48.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.997 0.427 . . . . 0.0 111.742 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 59.36 65.01 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.004 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' A' ' 578' ' ' LEU . 1.1 tp -88.48 152.64 21.75 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.646 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -178.77 6.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.952 0.406 . . . . 0.0 111.341 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.36 127.38 39.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.309 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.82 -86.16 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.326 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.46 97.94 10.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.534 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -117.54 109.83 17.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 53.6 p -90.32 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 34.4 p -89.76 5.52 45.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.412 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 614' ' ' LEU . 20.2 p -140.35 -48.1 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -106.91 165.05 11.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.74 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 571' ' ' GLN . 20.3 tt -150.55 146.23 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.359 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 85.0 m -109.17 123.65 49.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.675 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -111.43 131.24 55.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.7 t -127.05 137.55 53.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.382 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.457 ' CE2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -154.52 169.74 23.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.143 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.1 m -88.01 129.43 35.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.994 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.74 165.09 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.9 166.57 13.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.033 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -1.4 53.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.836 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -117.95 64.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.418 ' O ' ' HB ' ' A' ' 587' ' ' VAL . 34.4 t30 -70.9 -153.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.611 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 586' ' ' ASN . 47.3 t 74.98 -37.74 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -108.98 -28.09 4.59 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.854 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.416 HG22 ' OD1' ' A' ' 628' ' ' ASP . 21.8 t -68.87 124.26 24.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.607 0.241 . . . . 0.0 110.585 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 18.4 p -123.38 1.15 8.99 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.755 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.18 168.72 40.67 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.193 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -131.08 162.21 30.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.787 0.327 . . . . 0.0 110.602 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.48 ' OD1' HG23 ' A' ' 603' ' ' THR . 48.2 m-20 -126.83 135.44 51.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.868 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.406 HG11 HD11 ' A' ' 611' ' ' ILE . 47.2 t -100.15 129.07 51.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.25 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.431 ' CE2' ' HG3' ' A' ' 625' ' ' LYS . 33.7 m-85 -107.29 129.63 54.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.723 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -123.91 94.23 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 60.11 72.05 0.68 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.507 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 8.2 p 46.12 34.48 2.11 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.907 0.384 . . . . 0.0 111.356 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.51 107.9 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.759 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 3.9 tt -52.36 122.83 9.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.078 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -91.81 -95.27 0.13 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.247 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 7.6 t -90.73 177.01 6.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.104 0.478 . . . . 0.0 111.79 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . 0.48 HG23 ' OD1' ' A' ' 593' ' ' ASP . 7.5 m -140.61 134.17 30.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.545 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.778 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.4 m -136.67 -173.45 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.956 0.408 . . . . 0.0 111.589 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.755 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.6 p -131.81 -25.32 2.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.999 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -92.98 -151.19 27.64 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.484 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 17.7 p -100.41 12.94 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.843 0.354 . . . . 0.0 111.209 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.91 155.43 45.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.988 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.778 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.79 155.18 43.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.67 113.99 11.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.525 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -99.78 113.84 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.671 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 13.3 p -101.94 132.26 47.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.913 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.48 1.34 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.491 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 574' ' ' SER . 6.7 mt -137.0 114.35 10.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.768 0.318 . . . . 0.0 110.693 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -67.33 128.49 36.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -64.1 175.14 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.271 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 25.7 t70 57.09 30.39 18.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.07 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.4 m -140.18 144.74 36.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.45 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . 0.41 ' HA ' ' HB3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -87.87 134.45 33.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.396 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -127.8 139.32 52.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 111.443 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.1 p -117.96 117.9 30.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.11 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 576' ' ' ILE . 68.2 m-85 -106.68 171.31 7.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.328 0.585 . . . . 0.0 112.164 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.91 173.67 8.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.102 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.552 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -139.68 150.14 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.981 0.419 . . . . 0.0 111.448 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 634' ' ' SER . 7.6 mttt -140.54 123.46 16.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.203 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.03 134.85 35.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.308 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -131.63 149.9 52.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.831 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.416 ' OD1' HG22 ' A' ' 589' ' ' VAL . 1.8 m-20 -111.73 -179.6 3.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.12 43.07 1.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.041 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.52 5.27 0.61 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.208 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 86.95 9.27 74.36 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.462 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.7 m-80 -93.43 116.95 29.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.9 p -125.06 135.38 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.56 -160.34 0.15 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.993 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.48 -177.08 4.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.045 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -89.93 136.77 32.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.552 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -72.15 -174.27 1.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.778 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.31 142.64 42.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -88.13 126.19 34.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.097 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.443 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 10.2 p -101.02 124.86 54.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 3.4 p -95.96 89.85 5.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.867 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.56 132.27 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 619' ' ' SER . 0.4 OUTLIER -112.61 133.66 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 111.126 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.088 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.676 0.274 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.425 ' HB2' ' H ' ' A' ' 561' ' ' THR . 83.7 Cg_endo -79.11 -139.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.721 2.281 . . . . 0.0 112.456 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.487 HG21 ' OG1' ' A' ' 584' ' ' THR . 0.2 OUTLIER -114.22 134.78 54.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.864 0.364 . . . . 0.0 111.048 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.678 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -78.46 130.11 72.47 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.455 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 52.0 Cg_exo -54.23 171.57 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.68 2.253 . . . . 0.0 112.042 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.8 t -163.6 164.25 24.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.28 34.62 24.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.3 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.804 HD11 ' HG ' ' A' ' 578' ' ' LEU . 35.8 tp -60.92 158.83 12.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.467 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.63 -177.54 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.263 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.3 t -144.89 126.97 15.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.066 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 17.8 p -99.78 -81.02 0.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.545 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -83.3 104.28 13.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.584 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.17 89.85 3.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.459 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 79.5 p -80.96 -158.8 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 63.1 p -94.57 22.86 5.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.61 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.444 ' O ' HD12 ' A' ' 614' ' ' LEU . 2.9 p -168.74 -44.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.706 0.288 . . . . 0.0 111.458 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.25 138.78 41.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.67 HD11 HG11 ' A' ' 642' ' ' VAL . 9.5 tt -130.26 148.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -116.29 109.8 17.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.804 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.899 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . 0.441 ' O ' HD12 ' A' ' 566' ' ' LEU . 34.8 t -130.82 139.97 50.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.667 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.617 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -151.84 170.07 20.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 0.0 111.255 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.5 m -79.96 135.35 36.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.057 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.51 173.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 p -76.56 155.6 33.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.852 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . 0.487 ' OG1' HG21 ' A' ' 561' ' ' THR . 71.3 p -91.45 18.21 7.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -126.46 -69.34 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 55.11 30.81 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.031 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.52 -12.09 9.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.021 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -156.63 -4.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.428 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.8 t -62.58 133.2 28.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.7 0.286 . . . . 0.0 111.179 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.448 HG23 ' HE3' ' A' ' 627' ' ' LYS . 1.3 t -112.47 -24.05 9.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.175 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.548 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -170.96 -177.85 41.13 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.665 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -126.66 133.66 50.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.833 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.27 117.43 34.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.502 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.38 132.66 44.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.902 0.382 . . . . 0.0 111.067 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 93.1 m-85 -99.43 170.38 8.66 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.036 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -140.23 85.6 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.319 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.18 -67.38 2.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.984 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -155.5 -9.04 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.824 0.345 . . . . 0.0 110.998 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -59.12 132.96 55.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.351 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -98.65 -105.67 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.87 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.9 t -90.77 173.18 8.15 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.962 0.411 . . . . 0.0 111.497 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 4.9 m -139.09 126.97 22.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.654 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.9 m -126.45 -169.1 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.368 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.548 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 7.2 p -137.36 2.01 2.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.208 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -126.3 -147.47 6.85 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.424 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 81.5 p -105.12 25.92 9.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.347 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.6 OUTLIER -146.5 127.31 14.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.096 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.846 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.93 140.36 51.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.157 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -116.85 115.05 24.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.9 mt -114.12 110.46 32.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.189 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 574' ' ' SER . 0.5 OUTLIER -112.5 158.52 19.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.769 179.787 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.48 29.59 9.3 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.617 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.444 HD12 ' O ' ' A' ' 574' ' ' SER . 6.0 mt -91.4 -173.91 3.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.764 0.316 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -123.18 120.31 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.06 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -57.9 159.78 5.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.94 37.39 28.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.165 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.4 m -140.13 146.54 38.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.255 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 28.1 t -89.47 139.34 30.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.638 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -140.15 125.35 18.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 111.254 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.44 123.87 46.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.519 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.413 ' HB2' HG23 ' A' ' 640' ' ' VAL . 67.6 m-85 -115.66 169.08 9.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.244 0.545 . . . . 0.0 111.829 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -159.28 159.62 34.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.59 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.759 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -121.12 148.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.132 0.491 . . . . 0.0 111.948 -179.508 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 634' ' ' SER . 8.3 mttt -140.35 157.89 44.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.688 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.68 141.24 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.413 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.448 ' HE3' HG23 ' A' ' 590' ' ' THR . 0.0 OUTLIER -131.16 153.71 49.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.784 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.51 174.78 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.942 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.65 56.3 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.85 -42.31 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.178 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.79 2.95 1.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.472 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -86.81 144.89 26.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 110.849 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 9.8 m -136.03 148.89 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.366 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.429 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.6 OUTLIER -87.18 -161.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.788 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.678 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.06 169.46 11.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 111.012 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.97 140.25 30.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.428 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -78.84 -173.5 3.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . 0.457 ' ND2' ' HB3' ' A' ' 566' ' ' LEU . 0.9 OUTLIER -60.28 155.07 18.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.83 154.08 27.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.096 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 622' ' ' PHE . 2.9 m -136.93 109.12 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.52 111.16 22.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.706 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.67 HG11 HD11 ' A' ' 576' ' ' ILE . 0.9 OUTLIER -112.55 152.41 14.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.989 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -113.98 106.5 14.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.021 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.652 0.263 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.559 ' HG2' ' HB2' ' A' ' 634' ' ' SER . 74.4 Cg_endo -73.52 -148.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.493 HG23 ' HB2' ' A' ' 583' ' ' SER . 0.1 OUTLIER -119.0 128.25 54.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.934 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.13 128.73 91.34 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.246 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 80.3 Cg_exo -45.16 145.67 3.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.698 2.266 . . . . 0.0 112.086 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 32.8 p -127.82 156.16 42.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.37 . . . . 0.0 111.685 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.08 60.75 3.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.71 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.585 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 13.0 tp -79.29 158.29 27.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.585 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.69 175.07 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 0.0 111.673 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 578' ' ' LEU . 13.7 p -127.03 128.94 47.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.5 p -99.57 -84.55 0.41 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.359 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.36 148.89 25.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.368 . . . . 0.0 111.167 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 136.78 8.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.732 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.421 ' HB ' ' H ' ' A' ' 573' ' ' THR . 31.9 p -134.22 -155.3 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.12 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.743 HG22 ' HB2' ' A' ' 616' ' ' ALA . 0.0 OUTLIER -95.28 20.73 8.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.301 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 12.9 p -167.06 -41.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.51 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -109.75 155.85 21.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.275 -179.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.453 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 15.0 tt -159.26 134.98 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 111.242 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 55.6 m -104.46 141.7 35.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.962 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 608' ' ' THR . 54.6 mt -123.7 146.06 48.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 51.9 p -133.39 127.16 32.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.733 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.503 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.8 p90 -137.21 169.6 17.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.172 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.7 m -87.12 138.09 31.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.129 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.76 166.5 2.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.222 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.493 ' HB2' HG23 ' A' ' 561' ' ' THR . 34.9 p -73.61 -3.67 29.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.928 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 59.34 16.29 4.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.077 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -148.27 68.18 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.592 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.0 25.24 0.58 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.196 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.01 -19.27 21.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.985 0.422 . . . . 0.0 110.661 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -149.69 -14.81 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.242 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 17.3 t -66.02 144.29 14.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.778 0.323 . . . . 0.0 111.065 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 75.4 p -123.74 -48.7 1.9 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.281 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.593 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -140.44 -174.68 14.04 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.787 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -133.81 154.84 50.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.683 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -121.73 137.71 54.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.952 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.426 HG11 HD11 ' A' ' 611' ' ' ILE . 56.1 t -104.19 128.42 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.755 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.54 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 40.7 m-85 -102.2 126.84 49.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.305 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 7.7 p-10 -99.02 84.32 3.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.225 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 82.84 -72.53 2.82 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.226 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 17.2 p -147.45 3.41 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.663 0.268 . . . . 0.0 111.265 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -121.75 173.96 7.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.453 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -90.3 119.15 30.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.638 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -92.83 -104.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.364 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 15.1 t -90.64 173.49 8.02 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 111.616 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 3.1 m -139.52 119.76 13.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 609' ' ' ALA . 12.7 m -122.41 -172.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.506 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.593 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 27.7 p -141.6 -10.04 0.93 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.098 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -102.07 -123.8 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.61 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 26.3 p -122.12 -13.12 8.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.713 0.292 . . . . 0.0 111.245 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.439 ' O ' HG11 ' A' ' 604' ' ' VAL . 27.3 p -105.58 172.74 6.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.081 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.74 155.14 36.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.187 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -129.95 117.17 19.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.209 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 575' ' ' SER . 5.7 mt -115.84 109.82 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.013 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.8 m -107.66 155.37 20.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.839 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 90.65 54.52 2.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.538 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.9 mt -118.82 144.16 46.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.88 0.372 . . . . 0.0 110.937 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -94.91 137.91 33.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.028 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . 0.743 ' HB2' HG22 ' A' ' 573' ' ' THR . . . -68.11 162.08 25.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.422 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 55.51 43.3 28.74 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.307 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . 0.443 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 5.6 m -140.65 146.56 38.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.34 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.6 t -91.16 120.38 32.05 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.527 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . 0.443 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 74.8 m-85 -121.63 129.32 52.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.957 0.408 . . . . 0.0 111.524 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 64.0 p -104.33 141.02 37.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.92 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.655 ' H ' HG12 ' A' ' 640' ' ' VAL . 32.1 m-85 -129.31 169.05 15.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.274 0.559 . . . . 0.0 112.09 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.85 168.18 16.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.057 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.535 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -137.8 153.45 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.065 0.46 . . . . 0.0 111.56 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.54 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 1.4 mttp -140.41 149.95 43.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.92 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -105.18 136.92 43.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.505 ' HB3' HG22 ' A' ' 633' ' ' VAL . 0.3 OUTLIER -127.88 149.77 50.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.116 -179.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.464 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 1.8 m-20 -107.14 167.36 9.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.651 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.25 -8.92 58.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.149 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.628 ' HB3' HD21 ' A' ' 632' ' ' ASN . . . -92.56 -9.99 39.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 97.27 54.28 1.28 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.71 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.628 HD21 ' HB3' ' A' ' 630' ' ' ALA . 0.6 OUTLIER -137.93 131.68 31.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.779 0.323 . . . . 0.0 110.975 179.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 627' ' ' LYS . 24.9 t -126.32 132.79 70.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.253 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.559 ' HB2' ' HG2' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -79.28 -157.48 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 179.656 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -89.34 177.23 6.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.872 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -86.26 143.51 27.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.46 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -73.24 -170.13 0.73 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.35 146.87 42.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.632 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.06 134.33 36.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.219 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.655 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -99.78 154.43 4.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.935 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.03 81.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.04 132.31 45.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.898 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -105.54 111.92 24.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.244 179.976 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.602 0.239 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.44 ' HG2' ' HB3' ' A' ' 634' ' ' SER . 40.2 Cg_endo -65.95 173.97 6.37 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.481 2.121 . . . . 0.0 112.236 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 1.4 p -84.97 127.43 34.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.049 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.72 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.86 127.28 91.45 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.042 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.418 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.3 Cg_exo -46.18 133.61 15.22 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.657 2.238 . . . . 0.0 112.039 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 27.7 p -117.15 153.4 32.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.658 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 58.95 77.35 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.773 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' ' 578' ' ' LEU . 24.6 tp -83.7 162.4 20.73 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.563 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -159.22 167.31 29.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.0 111.672 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 80.2 p -128.71 136.37 50.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.53 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -112.07 -88.13 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.504 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.96 108.69 19.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.451 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.566 ' H ' HE21 ' A' ' 571' ' ' GLN . 0.0 OUTLIER -119.91 98.9 6.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.832 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.5 p -86.63 -152.54 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.709 ' HB ' ' HB2' ' A' ' 616' ' ' ALA . 30.4 p -101.56 -10.77 19.81 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.687 0.255 . . . . 0.0 111.687 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 76.2 p -125.71 -33.86 2.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -123.44 159.43 29.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.945 0.403 . . . . 0.0 111.171 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.577 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.0 tt -142.07 151.42 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 5.5 m -118.82 127.62 53.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -121.39 137.87 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.332 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 37.5 t -128.6 146.76 50.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.282 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.455 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 48.1 p90 -157.79 170.07 23.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.924 0.392 . . . . 0.0 111.323 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.74 125.51 29.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.233 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.34 153.14 35.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.347 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -70.72 169.72 13.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.22 -19.19 20.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.959 0.409 . . . . 0.0 111.114 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.601 ' O ' HG23 ' A' ' 589' ' ' VAL . 3.0 t0 -89.03 37.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.767 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -58.46 -13.31 5.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.2 3.45 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.059 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -143.65 -24.73 0.16 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 585' ' ' ASP . 10.2 t -61.24 144.98 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 111.066 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 16.6 p -124.69 -9.96 7.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.286 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.624 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.03 172.45 36.54 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.513 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -124.65 134.12 53.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 111.16 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -100.94 135.84 41.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.451 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.556 HG11 HD11 ' A' ' 611' ' ' ILE . 97.8 t -101.75 135.13 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.6 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 57.0 m-85 -112.6 129.5 56.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.647 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -122.06 107.85 12.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 57.88 59.59 10.55 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.291 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.1 p 52.64 33.24 13.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.949 0.404 . . . . 0.0 111.327 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.81 111.6 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -47.81 153.67 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.623 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -134.93 -86.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.307 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.6 t -90.5 171.24 9.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.191 0.52 . . . . 0.0 111.85 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 46.5 m -140.36 123.53 16.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.494 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.772 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.0 m -128.27 -169.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.926 0.393 . . . . 0.0 111.549 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.624 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.1 p -142.0 -31.55 0.54 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.964 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -76.26 -125.22 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.435 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 16.7 p -122.84 -13.09 7.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.734 0.302 . . . . 0.0 111.159 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 50.0 p -108.67 155.71 20.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.021 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.772 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.35 145.28 38.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.071 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.4 m -127.01 119.76 27.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.2 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.577 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.6 mp -104.75 139.51 25.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.936 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.83 163.74 16.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 80.6 39.27 14.78 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.509 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -96.55 162.76 13.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 110.996 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -125.46 127.03 45.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.913 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . 0.709 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -59.31 160.12 6.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.447 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.83 43.66 30.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.207 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.7 m -140.42 146.46 38.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.396 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 6.0 t -86.92 137.54 32.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.472 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -140.12 131.14 26.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.015 0.436 . . . . 0.0 112.113 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -106.31 130.33 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.482 178.647 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -123.17 166.96 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.375 0.607 . . . . 0.0 112.548 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.09 160.48 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.822 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.453 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -128.25 150.95 34.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.098 0.475 . . . . 0.0 111.574 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.527 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.9 mmtt -140.18 149.73 43.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.872 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.63 150.42 29.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.747 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 141.81 39.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.752 0.311 . . . . 0.0 111.208 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -108.04 165.23 11.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.29 9.98 21.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -96.19 -0.04 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.075 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 90.22 27.77 19.68 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.489 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -128.1 159.68 34.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.721 0.296 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.53 145.97 26.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HG2' ' A' ' 560' ' ' PRO . 51.4 p -82.71 -174.81 5.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.72 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.28 178.69 6.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.995 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.527 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -88.0 142.95 27.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.453 ' HB3' HG23 ' A' ' 624' ' ' VAL . 2.4 p -77.2 -166.8 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.216 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.02 140.35 45.37 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.787 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.72 119.52 22.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.814 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 621' ' ' THR . 8.7 p -99.88 138.36 24.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.165 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.9 t -107.13 89.15 2.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.699 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.438 HG21 HD11 ' A' ' 576' ' ' ILE . 3.7 m -110.02 141.15 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.595 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -95.97 163.17 13.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.653 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 616' ' ' ALA . 4.9 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.224 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.63 0.253 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.455 ' HB2' ' H ' ' A' ' 561' ' ' THR . 90.4 Cg_endo -76.94 -149.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.593 2.196 . . . . 0.0 112.256 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.522 HG21 HG23 ' A' ' 584' ' ' THR . 0.2 OUTLIER -113.97 114.49 26.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.046 179.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.44 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -60.58 128.89 88.99 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.983 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.24 151.77 4.14 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.492 2.128 . . . . 0.0 111.899 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.55 156.09 45.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 59.09 45.53 14.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.725 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 580' ' ' TRP . 48.8 tp -66.71 156.7 34.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.439 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.11 168.87 21.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.414 ' HA ' HD23 ' A' ' 578' ' ' LEU . 59.9 p -124.04 143.93 50.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.156 179.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 14.9 p -125.05 -86.35 0.63 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.578 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.79 98.89 8.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 111.194 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -118.28 102.4 8.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.86 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 15.1 p -87.87 -152.02 0.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.842 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.3 p -100.83 -22.65 14.78 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.672 0.272 . . . . 0.0 111.627 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.0 p -122.22 -7.63 8.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.318 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.19 165.18 27.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.898 0.38 . . . . 0.0 111.038 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.424 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 18.6 tt -156.32 144.52 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.011 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.9 m -120.74 127.6 52.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 568' ' ' SER . 45.2 mt -119.75 136.16 54.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.8 t -126.29 139.06 53.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.316 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.55 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -150.62 169.69 20.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.852 0.358 . . . . 0.0 111.378 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 16.6 m -79.93 131.31 35.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.154 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.23 178.67 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.427 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.8 OUTLIER -84.63 169.87 13.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . 0.522 HG23 HG21 ' A' ' 561' ' ' THR . 1.4 p -99.2 -15.54 18.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.722 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.454 ' O ' HG23 ' A' ' 589' ' ' VAL . 0.8 OUTLIER -118.04 61.28 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.017 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -73.83 1.53 10.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.005 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.75 -12.47 12.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.325 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -133.98 -18.92 0.93 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.594 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 585' ' ' ASP . 5.3 t -72.79 147.51 9.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.851 0.358 . . . . 0.0 111.105 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.5 p -117.91 -49.65 2.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.197 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.562 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -150.1 171.78 30.03 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.783 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -118.61 133.42 55.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.739 0.304 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.769 ' HB3' HD21 ' A' ' 600' ' ' LEU . 0.5 OUTLIER -111.35 120.5 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.943 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.37 138.36 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.811 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.493 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 95.7 m-85 -99.97 154.88 18.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.556 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.449 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 13.6 t30 -128.2 84.59 2.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.256 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 97.13 -71.06 0.75 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.426 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.26 4.36 0.14 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 111.378 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -128.2 172.09 11.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.769 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.0 OUTLIER -79.97 119.8 23.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.8 179.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.449 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -90.56 -105.47 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.011 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.4 t -90.5 162.27 15.12 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 111.238 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -127.69 128.83 46.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.635 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.0 m -134.45 -176.35 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.375 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.562 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 73.1 p -140.88 -15.42 0.9 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -91.46 -121.29 2.59 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.621 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.7 p -127.99 -4.41 5.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.831 0.348 . . . . 0.0 111.317 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.468 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -113.9 168.86 9.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.136 179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.635 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -154.27 119.4 5.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.915 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.5 m -107.33 120.21 41.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.409 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.424 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.3 mp -109.42 131.04 61.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.749 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 87.4 p -111.98 172.09 7.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 62.5 80.58 0.11 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.469 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.1 mt -137.87 179.58 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.856 0.36 . . . . 0.0 110.959 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -124.94 155.23 39.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.905 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 161.84 15.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.317 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 6.2 t70 55.68 43.4 28.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.059 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.37 139.05 35.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.333 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.2 t -86.05 131.24 34.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -129.34 137.39 50.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.282 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.13 119.44 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.379 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.409 ' HB2' HG23 ' A' ' 640' ' ' VAL . 71.7 m-85 -113.55 159.87 19.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 111.901 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.73 137.69 11.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.217 -0.902 . . . . 0.0 109.792 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.55 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -99.94 149.05 6.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.024 0.44 . . . . 0.0 111.569 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -136.79 152.94 50.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.04 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.45 137.63 50.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.236 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.44 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.437 ' OD1' HG22 ' A' ' 589' ' ' VAL . 4.2 m-20 -108.78 170.08 8.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.61 11.04 16.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.999 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -105.51 -13.52 15.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 98.88 41.34 3.11 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.547 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -135.93 130.4 33.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.5 t -124.7 131.09 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -77.09 175.21 9.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.929 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -65.26 168.05 7.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.265 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.51 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -79.53 140.15 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.438 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.2 t -67.66 -179.49 1.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.013 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -65.57 153.75 40.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.667 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.51 142.35 31.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.299 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.409 HG23 ' HB2' ' A' ' 622' ' ' PHE . 3.7 m -129.91 114.33 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.74 123.52 34.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.34 119.48 55.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.181 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -92.01 101.34 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.194 -0.907 . . . . 0.0 111.104 -179.872 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.551 0.215 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.17 -152.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.533 2.155 . . . . 0.0 112.445 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 583' ' ' SER . 5.7 m -111.53 131.31 55.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.012 0.434 . . . . 0.0 111.396 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.62 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.58 130.68 88.04 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.383 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.556 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -45.69 146.13 3.94 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.74 2.293 . . . . 0.0 111.819 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.3 p -119.95 137.13 54.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.992 0.425 . . . . 0.0 112.005 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 54.79 94.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.035 179.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.829 HD11 ' HG ' ' A' ' 578' ' ' LEU . 54.6 tp -89.8 160.36 16.55 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.524 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.75 178.74 9.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.422 . . . . 0.0 111.684 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.37 149.4 36.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.421 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 5.4 p -124.83 -84.82 0.64 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.602 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.48 112.5 20.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.433 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.57 ' HB2' HG13 ' A' ' 576' ' ' ILE . 3.4 tt0 -134.9 114.02 12.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.904 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 23.8 p -104.07 -165.78 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.82 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -91.17 29.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 11.3 p -162.33 -39.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.021 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.19 171.77 8.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.958 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.57 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.5 tt -159.48 151.19 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.419 . . . . 0.0 111.164 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.3 m -119.43 133.69 55.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.793 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.829 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -121.79 131.39 54.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.027 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.83 127.96 46.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.525 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.453 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -137.29 170.05 16.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.5 m -84.79 134.59 34.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.028 0.442 . . . . 0.0 111.344 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.55 168.63 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.009 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.746 ' HB3' ' HB ' ' A' ' 561' ' ' THR . 1.2 m -79.75 162.52 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.795 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.72 -7.15 58.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.793 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.508 ' O ' HG23 ' A' ' 589' ' ' VAL . 41.1 m-20 -125.16 64.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.823 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.06 0.92 16.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.71 -9.54 13.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.105 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -130.86 -21.22 1.12 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.405 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 585' ' ' ASP . 22.9 t -70.43 141.81 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.1 t -126.14 -11.43 6.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.111 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.602 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -178.03 -177.57 46.88 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.715 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -134.02 157.94 44.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.935 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -120.41 129.66 54.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.463 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.563 HG22 HG13 ' A' ' 624' ' ' VAL . 56.8 t -99.61 140.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.231 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 92.0 m-85 -123.64 147.93 46.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 621' ' ' THR . 25.1 t30 -137.95 88.91 2.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 76.29 59.26 3.39 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.093 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 43.4 p 50.46 44.46 26.94 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.891 0.377 . . . . 0.0 111.261 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.04 121.0 4.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.381 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 594' ' ' VAL . 1.0 OUTLIER -54.97 130.73 42.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.872 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -112.93 -98.65 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.349 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.7 t -90.61 171.6 9.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.117 0.484 . . . . 0.0 111.821 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 2.8 m -137.58 127.8 26.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.46 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.794 HG11 ' HA ' ' A' ' 609' ' ' ALA . 15.5 m -130.59 -178.22 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.906 0.384 . . . . 0.0 111.542 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.602 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 1.4 p -133.21 -24.93 1.81 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.168 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -85.64 -126.25 1.71 Allowed Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.467 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.44 7.93 6.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.827 0.346 . . . . 0.0 111.039 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -129.2 152.83 48.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.971 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.794 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -126.9 155.7 42.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.02 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 89.0 m -134.73 109.11 8.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.997 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.45 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -110.52 116.12 51.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.002 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.71 -174.44 2.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.862 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.27 47.65 77.99 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.635 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.2 mt -117.73 173.84 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.881 0.372 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -135.76 169.87 16.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -84.62 171.11 12.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.364 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 55.7 42.42 29.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.814 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.22 143.19 42.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.285 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . 0.47 ' HA ' ' HG3' ' A' ' 643' ' ' LYS . 0.1 OUTLIER -98.61 132.21 44.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.218 179.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -126.62 125.9 42.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.437 . . . . 0.0 111.911 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 596' ' ' ASN . 1.8 p -110.22 107.71 17.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.643 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.494 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 39.1 m-85 -100.15 156.33 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.523 0.677 . . . . 0.0 112.729 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -159.22 122.13 3.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.306 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.563 HG13 HG22 ' A' ' 594' ' ' VAL . 0.0 OUTLIER -99.17 157.45 3.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 0.0 111.739 -179.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 635' ' ' ALA . 0.2 OUTLIER -139.98 155.06 47.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.341 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -104.51 132.14 51.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.793 0.33 . . . . 0.0 110.945 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 632' ' ' ASN . 4.3 pttm -120.81 159.83 24.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.96 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 630' ' ' ALA . 0.4 OUTLIER -112.97 177.85 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -76.64 -19.8 57.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.648 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.468 ' H ' ' CG ' ' A' ' 628' ' ' ASP . . . -100.62 31.64 3.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.52 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 56.42 81.38 0.07 OUTLIER Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.726 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.461 ' O ' ' HA ' ' A' ' 627' ' ' LYS . 1.9 t-20 -160.38 126.64 4.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 0.0 110.716 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 6.5 m -121.89 143.91 32.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.96 0.41 . . . . 0.0 111.711 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.462 ' O ' ' HE2' ' A' ' 625' ' ' LYS . 0.9 OUTLIER -82.78 -145.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.075 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.62 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.68 177.19 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 110.998 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.51 138.15 31.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.945 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.556 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 12.8 p -67.57 -169.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.855 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -63.36 177.68 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -106.2 121.31 43.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.448 HG21 ' HG ' ' A' ' 566' ' ' LEU . 2.9 t -112.03 115.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.684 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 11.1 t -102.47 102.45 12.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.966 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.64 114.77 48.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.928 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.47 ' HG3' ' HA ' ' A' ' 619' ' ' SER . 0.0 OUTLIER -96.86 122.07 39.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.123 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.159 179.768 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.633 0.254 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.74 -179.2 3.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.683 2.255 . . . . 0.0 112.459 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.05 136.66 34.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.408 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -64.24 129.4 94.04 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.5 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.469 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.82 140.08 10.14 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.69 2.26 . . . . 0.0 112.201 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.6 t -122.96 153.64 39.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.907 0.384 . . . . 0.0 111.727 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.94 62.55 1.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.787 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.832 HD11 ' HG ' ' A' ' 578' ' ' LEU . 55.3 tp -82.4 158.93 23.12 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.423 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.28 176.03 11.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.996 0.426 . . . . 0.0 111.786 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 20.6 p -130.24 122.62 28.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.233 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.8 p -99.83 -86.8 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.69 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.02 96.76 10.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.252 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.81 102.45 9.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 80.9 p -94.69 -155.43 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.18 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 644' ' ' THR . 4.9 p -90.16 3.36 53.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.473 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 3.4 p -152.49 -49.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.66 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.495 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -99.96 122.28 42.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.794 0.33 . . . . 0.0 111.408 -179.536 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.441 HD12 HG21 ' A' ' 642' ' ' VAL . 14.5 tt -115.49 150.22 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 18.6 m -120.27 119.33 32.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.756 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.832 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -105.85 136.41 45.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.938 -179.617 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.8 122.69 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.549 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.4 p90 -138.45 169.59 17.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.029 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 m -85.27 147.32 26.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.216 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.42 168.19 7.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.339 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -2.15 36.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.885 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 21.45 11.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.168 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -153.12 75.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -87.68 33.86 0.71 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.977 0.418 . . . . 0.0 110.829 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -85.56 -1.25 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.986 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -159.99 -25.84 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 13.6 t -59.03 146.81 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 111.258 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.7 p -120.05 -40.0 2.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.601 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -159.53 177.29 36.11 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.394 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -123.09 120.12 32.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.812 0.339 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.52 ' OD1' HG22 ' A' ' 603' ' ' THR . 4.7 m-20 -99.81 120.96 40.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.553 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.69 140.36 19.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.21 170.71 8.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.004 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.453 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 10.5 t-20 -140.26 86.35 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.608 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 83.95 -68.34 3.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.257 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.4 p -151.28 -12.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 140.79 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.922 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -55.24 149.11 13.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -114.63 -107.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.011 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 5.0 t -90.73 168.93 11.38 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.155 0.502 . . . . 0.0 111.667 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . 0.52 HG22 ' OD1' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -132.37 121.26 23.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.543 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.849 HG11 ' HA ' ' A' ' 609' ' ' ALA . 31.5 m -125.64 -171.71 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.507 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.601 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.3 p -140.2 -12.41 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.145 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.11 -139.09 10.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.451 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 68.3 p -111.93 11.98 20.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 0.0 111.035 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -132.82 154.25 50.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.967 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.849 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.43 136.56 39.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.6 113.18 20.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.869 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.3 mt -107.26 144.09 16.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.55 -166.13 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 59.19 -108.56 1.67 Allowed Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.064 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.3 OUTLIER 56.89 104.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.958 179.109 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -70.01 111.69 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.634 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . 0.434 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -56.35 164.9 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.479 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 59.6 27.64 16.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.06 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.4 m -141.07 138.28 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.7 p -80.75 146.48 30.99 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.632 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -140.41 147.86 40.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.939 0.4 . . . . 0.0 111.56 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.536 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.49 120.29 39.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.06 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.468 ' CE1' HD13 ' A' ' 611' ' ' ILE . 96.9 m-85 -109.2 163.01 13.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.32 0.581 . . . . 0.0 112.213 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.09 142.92 19.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.604 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.578 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -107.94 142.5 20.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.076 0.465 . . . . 0.0 111.633 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -132.42 143.34 49.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.898 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.448 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -103.87 138.47 40.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.52 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.2 OUTLIER -128.55 137.0 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 0.0 OUTLIER -101.42 168.03 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.981 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.84 51.84 2.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.107 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -152.53 -25.43 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.21 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 116.58 28.66 2.47 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.302 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -121.9 124.63 44.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 0.0 110.682 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.52 HG12 ' HB3' ' A' ' 627' ' ' LYS . 9.4 m -120.83 135.82 59.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.375 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.448 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 10.2 p -69.85 -167.52 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.408 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.26 164.04 14.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -74.86 126.58 31.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.498 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.92 -177.12 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.624 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.11 157.67 9.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.536 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -90.35 131.17 36.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 3.1 m -114.04 109.71 29.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.049 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.6 119.77 27.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.441 HG21 HD12 ' A' ' 576' ' ' ILE . 12.1 m -123.88 160.28 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.222 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.68 112.18 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 573' ' ' THR . 62.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.168 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.578 0.228 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.56 -159.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.569 2.18 . . . . 0.0 112.276 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 583' ' ' SER . 4.5 p -112.59 123.63 50.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.11 132.22 87.37 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.699 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 78.5 Cg_exo -49.98 176.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.101 2.534 . . . . 0.0 112.413 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 5.1 t -155.66 148.92 24.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 111.605 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 56.77 68.01 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.653 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.884 HD11 ' HG ' ' A' ' 578' ' ' LEU . 49.4 tp -76.78 159.8 29.82 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.49 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.76 179.95 8.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.945 0.402 . . . . 0.0 111.567 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 82.3 p -142.67 130.21 21.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.463 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.7 p -100.6 -82.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.404 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . 0.492 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -86.12 97.08 10.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.25 97.19 7.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.6 p -84.14 -150.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.956 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 36.4 p -96.12 -45.24 6.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.73 0.3 . . . . 0.0 111.575 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 91.6 p -107.71 -3.68 18.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.625 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -139.69 163.7 31.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 111.135 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.473 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.5 tt -155.06 149.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.314 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.2 m -110.7 125.45 53.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.803 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.884 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.6 OUTLIER -108.94 149.26 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.245 -179.566 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.5 t -144.64 135.05 24.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.256 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.541 ' CD2' HG11 ' A' ' 624' ' ' VAL . 42.0 p90 -152.67 169.87 21.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.969 0.414 . . . . 0.0 111.36 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.6 110.61 16.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.781 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -51.18 151.32 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.304 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 561' ' ' THR . 0.0 OUTLIER -54.44 136.26 44.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.904 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 4.1 m -62.6 -23.63 67.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.858 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.04 46.46 1.01 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.485 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -65.04 -9.62 23.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.1 m -75.04 3.02 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.897 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -142.42 -2.9 1.06 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.427 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 627' ' ' LYS . 44.7 t -96.22 146.84 6.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.797 0.332 . . . . 0.0 110.967 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 8.1 t -111.2 -31.53 7.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.632 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -164.44 -179.9 38.84 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.878 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.41 135.52 44.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.435 ' OD1' HD11 ' A' ' 600' ' ' LEU . 0.3 OUTLIER -113.69 121.23 43.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.356 179.358 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.402 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -99.55 140.78 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.947 0.404 . . . . 0.0 111.206 -179.588 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -98.97 166.16 11.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.978 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -140.24 86.94 2.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 71.49 60.79 4.18 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.009 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.7 p 55.37 37.45 28.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.92 0.39 . . . . 0.0 111.487 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.65 112.25 2.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.435 HD11 ' OD1' ' A' ' 593' ' ' ASP . 1.1 tm? -45.88 131.17 9.58 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.353 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -113.08 -96.89 0.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.353 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.2 t -90.6 168.29 11.91 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.186 0.517 . . . . 0.0 111.985 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 18.2 m -132.5 141.6 48.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.575 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 3.5 m -140.35 -177.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.431 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.456 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 36.4 p -140.25 -13.27 1.04 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.932 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -98.1 -124.88 5.09 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.61 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.13 -14.67 8.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.3 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -101.24 176.64 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -158.78 123.57 4.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.138 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.6 m -105.42 117.27 33.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.235 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.7 mt -106.8 125.34 62.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.75 173.35 6.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.02 67.62 1.96 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.551 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 644' ' ' THR . 1.2 mp -130.59 153.5 48.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.966 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -121.45 141.45 50.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.158 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.93 174.31 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.68 28.72 14.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.2 m -139.16 141.42 38.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.99 137.38 32.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.587 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -132.62 133.19 43.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.391 . . . . 0.0 111.409 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -113.92 111.44 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.285 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -102.11 165.36 11.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.215 0.531 . . . . 0.0 111.913 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.495 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.6 OUTLIER -160.22 150.26 18.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.75 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.541 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -110.49 145.71 16.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.174 0.511 . . . . 0.0 111.777 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 1.1 mmtp -134.37 127.58 31.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.775 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.71 142.91 32.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.595 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.59 145.15 38.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -107.13 -177.51 3.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -86.23 -9.2 56.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.4 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -87.66 -6.0 58.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.129 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 91.09 23.34 30.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.4 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 2.4 m120 -108.27 148.09 30.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.686 0.279 . . . . 0.0 110.698 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.595 HG12 ' HB3' ' A' ' 627' ' ' LYS . 16.7 m -137.66 146.34 27.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.907 0.384 . . . . 0.0 111.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.85 -166.05 1.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.556 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.43 169.88 16.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.493 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.09 135.62 36.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.54 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -68.72 -175.27 0.66 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.426 -179.703 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 142.62 57.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.695 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.495 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -81.72 123.11 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 9.6 p -99.66 144.46 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.734 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.9 t -118.89 109.74 16.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.87 134.2 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.34 115.93 28.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.723 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . 0.544 HG21 HD23 ' A' ' 614' ' ' LEU . 21.9 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.005 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.573 0.225 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.45 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.428 2.085 . . . . 0.0 112.25 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.439 HG21 ' H ' ' A' ' 584' ' ' THR . 0.1 OUTLIER -103.77 130.41 51.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.968 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.27 126.9 92.51 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.456 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.6 Cg_exo -47.5 148.15 5.69 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.556 2.171 . . . . 0.0 112.094 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 30.6 p -138.58 161.11 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 111.387 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.1 51.85 8.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.609 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.906 HD11 ' HG ' ' A' ' 578' ' ' LEU . 11.5 tp -73.89 158.61 34.15 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.583 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -177.64 6.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 111.531 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 86.8 p -138.97 125.72 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.368 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.1 p -99.8 -86.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.509 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.19 102.78 15.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.195 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.492 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.7 OUTLIER -121.25 116.86 25.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.957 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.5 p -98.56 -159.15 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.195 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.75 2.43 54.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.536 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.47 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.3 p -142.39 -47.99 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.803 0.335 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 1.0 OUTLIER -100.08 166.37 11.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.82 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.492 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.3 tt -154.91 142.58 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 7.0 m -109.21 113.55 26.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.78 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.906 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.0 OUTLIER -102.86 134.06 46.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.203 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 t -128.64 133.97 48.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.54 ' CE2' HG11 ' A' ' 624' ' ' VAL . 42.9 p90 -146.94 169.76 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.171 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -79.98 132.4 36.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.262 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.15 159.8 28.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.094 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.2 p -74.78 158.73 32.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.79 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . 0.439 ' H ' HG21 ' A' ' 561' ' ' THR . 0.1 OUTLIER -69.86 -17.87 63.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.265 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -103.42 161.73 13.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -160.96 -10.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -6.34 8.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.746 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.33 -35.44 0.37 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.506 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 589' ' ' VAL . 4.7 t -59.07 148.45 6.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.5 -19.27 2.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.369 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.73 173.42 46.05 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.806 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -127.84 130.4 48.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.683 0.278 . . . . 0.0 110.836 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.84 126.26 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.614 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.443 HG21 HD11 ' A' ' 611' ' ' ILE . 0.2 OUTLIER -100.48 137.19 28.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.01 0.433 . . . . 0.0 111.625 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.753 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 98.0 m-85 -102.36 157.61 16.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.87 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -140.4 100.19 3.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.625 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 58.18 68.56 1.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.202 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.2 p 48.12 33.26 3.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.424 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.47 105.7 1.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.768 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.753 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.5 OUTLIER -47.92 137.7 9.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.386 -179.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.28 -98.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.9 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 4.0 t -90.64 168.39 11.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.185 0.517 . . . . 0.0 111.741 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 5.1 m -133.19 134.58 44.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.302 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.9 m -134.54 -179.75 3.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.496 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.554 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 40.5 p -132.29 -5.94 3.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.31 -131.04 6.9 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.471 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.09 4.69 10.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 111.063 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.469 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -128.63 140.1 51.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.9 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.829 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.79 157.77 27.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.164 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.75 102.46 5.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.962 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.462 HD13 ' CE1' ' A' ' 622' ' ' PHE . 4.2 mt -99.64 121.03 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.98 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.8 t -110.91 174.75 5.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.45 62.28 4.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.466 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 574' ' ' SER . 7.9 mt -130.74 143.14 50.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.866 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.24 142.92 35.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.043 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -76.99 159.22 30.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.285 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 11.5 t0 55.48 49.68 16.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.065 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.3 m -139.96 144.55 37.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . 0.528 ' HA ' ' HG2' ' A' ' 643' ' ' LYS . 13.6 t -85.12 112.77 20.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.518 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.3 m-85 -115.83 134.54 54.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.954 0.406 . . . . 0.0 111.607 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.464 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.3 OUTLIER -111.31 125.34 53.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.235 179.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.462 ' CE1' HD13 ' A' ' 611' ' ' ILE . 73.2 m-85 -118.96 162.09 19.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.27 0.557 . . . . 0.0 111.935 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.03 138.56 10.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.861 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.54 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.78 151.6 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.065 0.46 . . . . 0.0 111.691 -179.576 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.435 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.6 mmtp -136.77 143.19 43.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.945 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -101.7 143.24 31.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.679 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.0 149.71 45.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.708 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.27 174.89 5.65 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.15 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.37 45.48 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.373 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -151.34 -17.47 0.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.957 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 105.44 36.5 2.84 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.343 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.516 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 87.5 m-20 -119.15 109.56 16.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.762 0.315 . . . . 0.0 110.827 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 627' ' ' LYS . 25.5 m -109.08 131.25 60.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.296 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -168.63 0.72 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.659 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -72.91 173.22 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.834 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.435 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -88.46 136.46 32.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.856 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.413 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.8 t -63.98 -174.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.273 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 143.71 48.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.686 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.544 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.68 127.59 32.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.281 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 640' ' ' VAL . 7.4 p -104.39 116.25 47.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.93 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.45 81.39 6.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.557 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 11.0 p -103.78 139.69 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.172 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.528 ' HG2' ' HA ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -111.54 155.53 23.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.654 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.246 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.538 0.209 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.91 -144.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.663 2.242 . . . . 0.0 112.168 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.706 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -117.0 121.23 40.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.5 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.42 130.12 94.06 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.142 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.481 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.2 Cg_exo -48.95 170.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.808 2.339 . . . . 0.0 112.341 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 4.6 t -158.49 159.13 35.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.252 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 55.88 59.68 3.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.492 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.748 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.1 tp -85.58 155.51 21.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.658 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.74 175.52 12.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.322 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 18.8 p -123.72 134.23 53.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.6 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.99 -86.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.275 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.66 98.58 11.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.422 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.519 ' NE2' ' HB ' ' A' ' 642' ' ' VAL . 11.1 tt0 -111.36 134.5 52.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 24.1 p -126.18 -162.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 35.5 p -94.0 24.25 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.244 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 53.2 p -165.79 -47.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.1 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -114.57 126.82 55.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.186 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.493 HG13 ' HB2' ' A' ' 571' ' ' GLN . 18.1 tt -120.44 144.78 28.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.061 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -104.63 133.03 50.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.748 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -121.78 143.86 49.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.02 0.438 . . . . 0.0 111.386 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -139.4 138.59 36.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.396 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.584 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.4 p90 -153.55 169.67 22.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 111.269 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.49 128.37 33.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.184 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.54 169.64 2.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.706 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 11.3 p -67.9 -13.89 62.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.17 11.86 4.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.279 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -109.9 -65.05 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.634 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 41.1 t30 55.85 21.22 4.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.235 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.31 -25.25 36.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -162.78 2.11 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.405 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 10.2 t -64.93 146.27 13.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.32 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 629' ' ' ALA . 20.7 p -115.7 -38.96 3.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.46 176.82 40.97 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.717 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -117.85 149.29 41.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.724 0.297 . . . . 0.0 110.724 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.56 116.28 20.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.876 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.98 137.52 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -99.44 168.75 9.79 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.087 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.572 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 6.2 t-20 -135.15 88.07 2.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.541 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 93.84 -64.13 1.8 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.238 -179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -152.96 -39.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -90.27 171.15 9.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -75.06 133.12 41.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -99.8 -107.44 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.91 168.02 12.0 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.156 0.503 . . . . 0.0 111.554 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 16.6 m -131.49 133.5 45.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.542 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.2 m -137.87 -174.07 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.561 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.477 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.5 p -138.88 -15.87 1.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.045 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.68 -146.96 20.85 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.743 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.7 p -104.65 20.27 18.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 111.194 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.44 ' O ' HG11 ' A' ' 604' ' ' VAL . 38.6 p -136.49 160.88 37.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.964 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.32 148.3 42.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.0 106.25 7.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 575' ' ' SER . 2.7 mp -99.91 122.86 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.807 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 83.1 p -100.32 172.6 7.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.928 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 75.73 -87.71 0.85 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.373 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.447 ' HB3' ' H ' ' A' ' 615' ' ' ALA . 1.5 mt 47.62 -156.92 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.836 0.351 . . . . 0.0 111.505 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . 0.447 ' H ' ' HB3' ' A' ' 614' ' ' LEU . . . -164.58 134.74 3.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.791 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -81.96 166.11 20.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.496 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.69 35.92 24.67 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.172 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.33 168.53 19.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.215 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.84 120.72 40.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.192 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -122.9 151.0 42.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.098 0.475 . . . . 0.0 111.993 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -124.87 130.2 51.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.756 178.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.449 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 84.2 m-85 -114.63 155.75 25.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.419 0.628 . . . . 0.0 112.385 -178.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.7 p -149.14 148.55 29.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.502 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.584 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -116.54 153.87 18.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.983 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 0.5 OUTLIER -140.0 171.64 13.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.664 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.9 125.97 38.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.316 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -116.23 152.09 34.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.998 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -109.68 176.43 5.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.926 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 590' ' ' THR . . . -90.22 45.95 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.208 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.38 -28.44 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.045 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 123.1 6.71 7.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.343 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -96.94 119.9 36.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.6 p -115.9 147.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.91 -159.72 0.4 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.599 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.5 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.14 177.07 6.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.901 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -87.84 150.54 23.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.979 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.474 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -86.1 -171.87 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -64.93 159.77 22.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -100.81 123.76 45.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.22 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.7 p -99.89 123.34 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.03 103.51 15.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.671 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.519 ' HB ' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -107.52 146.32 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.222 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -104.19 108.15 19.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.732 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.138 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.537 0.208 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.426 ' HD3' ' HB2' ' A' ' 632' ' ' ASN . 70.7 Cg_endo -72.99 -153.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.616 2.211 . . . . 0.0 112.314 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 2.4 m -116.11 136.17 53.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -74.9 128.67 84.77 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.151 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.411 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 77.0 Cg_exo -47.45 154.4 1.64 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.681 2.254 . . . . 0.0 112.211 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.84 153.83 47.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.295 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 57.03 66.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.359 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.828 HD11 ' HG ' ' A' ' 578' ' ' LEU . 36.3 tp -86.93 159.8 18.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.276 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.479 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.44 172.93 15.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 0.0 111.732 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.39 135.03 49.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.176 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.68 -85.86 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.775 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . 0.474 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -85.08 102.88 13.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.863 0.364 . . . . 0.0 111.482 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.88 130.61 55.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 63.6 p -124.32 -156.81 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.297 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.2 p -94.69 22.58 6.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.408 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.502 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.2 p -164.71 -48.76 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.123 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.68 164.53 11.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.935 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.406 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 12.3 tt -158.29 145.6 8.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.329 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.474 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.0 m -107.32 136.11 47.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.497 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.828 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -127.63 125.5 40.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.872 0.367 . . . . 0.0 111.313 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 29.2 t -121.67 137.92 54.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.354 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.565 ' CD2' HG11 ' A' ' 624' ' ' VAL . 46.4 p90 -150.5 169.7 20.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.36 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 29.9 m -82.24 139.54 34.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.039 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.52 167.93 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.935 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 90.6 p -69.83 -3.98 18.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 9.9 p 52.52 24.36 3.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.007 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -124.0 -54.45 1.72 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 45.62 -154.74 0.04 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.825 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.4 t 54.32 19.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.151 0.501 . . . . 0.0 110.595 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -170.74 -28.79 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.801 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 591' ' ' GLY . 15.5 t -80.01 134.8 26.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.529 0.205 . . . . 0.0 110.629 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.494 HG21 ' HB2' ' A' ' 629' ' ' ALA . 31.4 p -124.96 23.96 7.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.75 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 152.16 167.86 15.71 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.247 -0.977 . . . . 0.0 113.182 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.27 127.27 37.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.85 0.357 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.656 ' HB3' HD11 ' A' ' 600' ' ' LEU . 2.7 m-20 -105.39 116.96 32.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.338 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.31 137.37 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.933 0.397 . . . . 0.0 111.268 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.422 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 87.1 m-85 -99.68 169.4 9.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.269 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -133.96 84.53 2.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 598' ' ' THR . . . 91.15 -52.66 3.19 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.224 -179.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.7 OUTLIER -158.53 -50.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.736 0.303 . . . . 0.0 111.225 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.85 173.48 12.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.958 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -79.33 149.29 31.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.418 ' N ' ' HG ' ' A' ' 600' ' ' LEU . . . -116.34 -104.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.748 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.417 ' CG2' ' HB1' ' A' ' 609' ' ' ALA . 9.9 t -90.92 162.65 14.67 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 111.151 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 22.8 m -127.33 117.13 21.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.899 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 609' ' ' ALA . 19.8 m -124.22 -173.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.507 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.75 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 25.1 p -140.75 -11.86 1.0 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.056 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.58 -140.84 11.56 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.632 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.93 27.99 9.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.786 0.326 . . . . 0.0 111.317 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.522 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.3 OUTLIER -149.93 153.24 36.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.949 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.735 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -137.49 144.09 42.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.028 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 34.5 m -122.35 110.89 16.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.281 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.406 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.6 mp -105.24 122.02 58.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.957 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 7.7 t -117.68 170.39 8.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.856 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 76.83 52.62 5.74 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.383 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 574' ' ' SER . 6.6 mt -122.27 161.8 22.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.87 0.367 . . . . 0.0 110.926 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.81 158.77 16.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -85.57 164.72 17.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.254 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 37.9 t0 55.91 42.33 28.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.222 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.5 m -140.54 139.24 35.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.407 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.68 136.43 35.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.237 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -135.73 118.66 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 111.739 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.97 107.4 18.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.906 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -99.52 160.48 14.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.363 0.602 . . . . 0.0 112.035 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 638' ' ' ASN . 4.5 p -150.89 152.88 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.835 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -113.83 152.87 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 111.482 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.0 mmtt -140.17 148.95 42.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.192 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -107.64 139.18 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.111 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.2 149.68 52.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.989 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -113.73 169.89 8.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.866 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . 0.494 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -81.75 7.81 11.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.151 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -104.15 -11.35 17.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.999 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 100.97 15.04 29.65 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.445 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.426 ' HB2' ' HD3' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -97.18 141.21 30.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.3 t -133.78 129.33 54.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.02 -171.59 2.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.41 176.0 10.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.18 134.5 34.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 5.0 t -66.0 -179.46 0.74 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.149 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . 0.539 ' ND2' ' H ' ' A' ' 566' ' ' LEU . 1.9 p30 -59.47 163.2 4.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.704 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -96.37 129.04 43.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.42 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.97 105.64 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 73.5 m -84.56 96.17 9.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 1.7 m -113.8 126.56 71.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.984 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -86.63 144.4 27.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.098 179.793 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.517 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 120.597 0.237 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -72.72 -165.55 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.506 2.137 . . . . 0.0 112.336 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.77 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 22.8 m -94.2 136.87 34.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.697 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -74.14 129.63 84.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.117 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.541 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -46.45 146.98 4.51 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.486 2.124 . . . . 0.0 112.053 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.1 154.21 51.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.968 0.413 . . . . 0.0 111.646 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.72 70.38 0.64 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.466 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.661 HD23 ' HB ' ' A' ' 640' ' ' VAL . 23.9 tp -83.63 159.59 21.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.391 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.529 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.95 169.77 21.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.834 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.478 ' HA ' HD23 ' A' ' 578' ' ' LEU . 0.0 OUTLIER -124.69 134.2 52.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.417 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.6 p -109.8 -89.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.533 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.52 99.95 12.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.83 0.347 . . . . 0.0 111.367 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.524 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -122.6 120.85 34.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.8 p -110.18 -160.25 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.989 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 68.1 p -93.07 27.96 2.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.055 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.6 p -165.71 -58.6 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -102.73 129.57 49.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.93 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.524 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.0 tt -120.76 142.89 34.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.387 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 3.1 m -117.21 126.68 53.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.494 ' O ' ' HA ' ' A' ' 608' ' ' THR . 87.5 mt -119.85 146.44 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.525 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 144.72 51.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.995 179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CH2' HG11 ' A' ' 624' ' ' VAL . 47.8 p90 -154.61 170.18 22.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 111.282 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.52 131.22 34.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.815 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.06 176.66 0.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.405 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.77 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 23.7 p -74.55 147.18 41.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.968 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -10.73 59.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.178 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -91.42 -63.13 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 55.81 29.75 14.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.039 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.55 -24.88 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -163.4 6.53 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.9 121.56 13.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 111.112 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.441 HG21 ' HB2' ' A' ' 629' ' ' ALA . 1.3 t -119.48 -29.77 5.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.27 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.669 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -139.78 174.77 22.18 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.748 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.58 162.71 31.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.72 0.295 . . . . 0.0 110.691 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.09 119.11 20.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.858 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.674 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.69 146.27 9.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.866 0.365 . . . . 0.0 110.988 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 34.5 m-85 -120.17 164.66 15.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.822 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -140.32 87.6 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.627 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 67.63 71.35 0.95 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.153 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.7 p 47.49 39.6 9.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.928 0.394 . . . . 0.0 111.221 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -160.33 102.05 1.39 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.057 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -49.21 136.3 15.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.154 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -111.91 -98.4 0.42 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.306 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 594' ' ' VAL . 6.5 t -90.6 170.68 9.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.305 0.574 . . . . 0.0 111.983 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.8 m -136.54 137.26 40.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.864 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.632 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.3 m -132.03 -176.1 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.929 0.395 . . . . 0.0 111.955 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.669 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.7 p -130.61 -6.92 4.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.734 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.78 -147.38 9.71 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.536 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.2 p -100.18 1.99 42.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.694 0.283 . . . . 0.0 111.456 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.535 ' O ' HG21 ' A' ' 604' ' ' VAL . 11.6 p -114.32 165.58 12.56 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.632 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -151.03 134.13 15.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.2 m -121.84 122.77 40.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.307 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.478 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.8 mp -112.76 128.65 69.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.779 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.0 155.46 20.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.0 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 78.45 58.05 3.21 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.509 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.0 mt -115.01 154.5 28.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -103.43 144.77 30.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.021 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -87.39 164.2 16.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.65 35.27 22.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.87 156.93 47.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.336 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.3 t -95.05 137.53 33.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -139.41 134.73 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 111.269 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 37.4 p -114.21 125.65 54.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.078 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.404 ' CE2' HD13 ' A' ' 576' ' ' ILE . 92.8 m-85 -113.46 155.14 25.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.279 0.562 . . . . 0.0 111.957 -179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.51 122.58 5.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.827 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.674 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.1 OUTLIER -99.25 157.55 3.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.139 0.495 . . . . 0.0 112.029 -178.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 5.7 mttt -136.85 163.54 30.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.411 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.431 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -111.08 133.55 53.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 0.0 111.089 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -126.36 143.84 51.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.958 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -107.52 156.26 19.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.822 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . 0.441 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -82.51 62.69 6.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.405 ' HB3' ' OD1' ' A' ' 628' ' ' ASP . . . -157.89 -39.11 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.974 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 134.06 44.15 0.12 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.771 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 63.3 m-80 -141.91 147.95 37.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.728 0.299 . . . . 0.0 110.927 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -137.36 144.99 30.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.209 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 8.2 p -87.4 -164.69 1.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.752 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.697 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.88 177.49 6.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.548 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.558 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.75 141.55 31.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 111.228 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.541 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -72.29 -177.39 2.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.922 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.39 144.18 47.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.689 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.94 112.29 17.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.323 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.661 ' HB ' HD23 ' A' ' 566' ' ' LEU . 1.2 t -100.02 137.13 28.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.591 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.8 m -116.53 109.92 17.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.984 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.8 p -115.37 149.72 17.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.996 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -114.86 128.99 56.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.036 179.816 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.483 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 CA--C 1.527 0.074 0 CA-C-O 120.684 0.278 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.448 ' HB3' HG22 ' A' ' 589' ' ' VAL . 85.2 Cg_endo -81.28 -157.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.629 2.219 . . . . 0.0 112.418 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.86 150.29 28.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.79 128.06 64.92 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.402 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.6 Cg_exo -48.1 153.05 3.0 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.703 2.269 . . . . 0.0 112.146 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.07 160.19 41.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.464 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 59.64 45.36 13.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.248 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.456 HD12 ' H ' ' A' ' 567' ' ' ALA . 63.9 tp -68.07 158.12 33.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.76 0.314 . . . . 0.0 110.68 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.456 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -162.07 -176.74 5.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.321 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.505 ' HA ' HD23 ' A' ' 578' ' ' LEU . 83.8 p -123.37 156.64 35.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.32 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.49 -89.4 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.727 0.299 . . . . 0.0 111.478 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.04 101.46 13.8 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.19 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.82 99.75 7.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.966 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 19.6 p -95.2 -155.18 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.812 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 14.4 p -96.99 19.59 12.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.51 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.546 ' O ' HD12 ' A' ' 614' ' ' LEU . 92.8 p -165.93 -46.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.136 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.78 137.88 39.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.434 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -133.1 141.25 45.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.43 131.84 55.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.011 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 76.2 mt -121.89 134.96 54.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.906 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 5.5 t -118.76 140.61 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.679 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.529 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.6 p90 -152.67 169.72 22.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.085 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.4 m -84.68 115.23 22.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -50.92 153.35 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.199 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.93 142.42 15.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.764 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 23.2 p -59.84 -15.35 20.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.228 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -112.46 153.91 26.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.034 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.693 HD22 HG23 ' A' ' 587' ' ' VAL . 0.3 OUTLIER -153.06 -157.83 0.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.548 179.924 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.693 HG23 HD22 ' A' ' 586' ' ' ASN . 28.2 t 71.29 -22.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.365 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -124.8 -20.84 2.25 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.088 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.448 HG22 ' HB3' ' A' ' 560' ' ' PRO . 96.4 t -70.13 141.8 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 110.693 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -102.42 -67.07 0.89 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.8 -179.336 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.632 ' H ' HG23 ' A' ' 590' ' ' THR . . . -145.38 -176.36 19.27 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.005 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -121.79 127.35 50.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.887 0.375 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.44 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 5.5 m-20 -101.65 118.3 36.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.423 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.73 135.18 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.957 0.408 . . . . 0.0 110.909 -179.791 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.728 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.0 m-85 -102.59 151.1 22.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.847 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -127.74 93.14 3.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.178 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 50.7 72.93 0.42 Allowed Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.926 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.5 p 50.07 37.41 14.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.075 0.464 . . . . 0.0 110.931 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.9 94.66 1.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.728 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.728 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.3 tt -44.92 129.96 7.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.441 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.58 -103.05 0.19 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.129 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.4 ' O ' HG13 ' A' ' 594' ' ' VAL . 12.5 t -90.65 172.51 8.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.139 0.495 . . . . 0.0 111.683 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . 0.428 HG23 ' OD1' ' A' ' 593' ' ' ASP . 63.1 m -138.32 105.29 5.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.268 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.8 m -105.98 -167.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.576 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.603 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.0 p -142.88 -0.55 1.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.031 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.88 -143.02 7.75 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.655 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.422 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 4.8 p -104.39 6.92 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.086 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -126.22 141.38 51.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.303 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -127.15 117.81 23.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.961 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.19 118.94 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.235 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.434 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -111.86 129.78 66.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.081 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 6.6 p -117.33 142.49 47.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 97.55 64.2 0.89 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.51 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.546 HD12 ' O ' ' A' ' 574' ' ' SER . 3.5 mt -130.86 158.47 40.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.846 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -110.64 138.73 46.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.154 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.83 172.37 8.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.177 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 28.4 t0 56.32 34.91 24.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.262 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.21 141.7 35.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.484 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.92 130.09 35.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.617 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -130.78 142.1 50.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.92 0.391 . . . . 0.0 111.501 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 1.3 m -120.4 133.35 55.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.342 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -121.88 156.79 32.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 0.0 112.068 -179.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 3.1 p -152.53 131.6 12.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.587 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.529 HG11 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -98.84 153.43 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.303 0.573 . . . . 0.0 111.804 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.637 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mttt -140.5 143.39 35.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.492 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -103.76 116.52 32.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 0.0 111.741 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.44 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -108.52 149.53 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.537 179.524 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.44 160.25 14.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.754 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.41 50.39 1.45 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.424 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -155.87 -35.19 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.012 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 132.21 39.74 0.22 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.396 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.483 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 1.5 t-20 -136.16 116.57 13.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.7 p -116.44 146.08 21.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.007 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.25 -167.0 1.7 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -77.14 -179.29 5.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.097 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.19 144.78 25.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.999 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.407 ' OG ' HG23 ' A' ' 624' ' ' VAL . 2.5 p -75.58 -174.89 2.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.917 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -64.9 150.1 48.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.785 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -83.92 128.19 34.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.204 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -111.78 105.39 18.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.991 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.2 91.44 8.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.973 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -99.61 171.61 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -143.5 128.8 18.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.839 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.139 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.57 -152.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.485 2.123 . . . . 0.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.601 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 17.8 m -113.67 127.75 56.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.119 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.521 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -61.42 131.72 92.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.445 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.51 159.61 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.883 2.389 . . . . 0.0 112.141 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.4 p -134.49 138.03 44.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.997 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.73 84.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.202 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.871 HD11 ' HG ' ' A' ' 578' ' ' LEU . 10.6 tp -90.63 159.39 16.44 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.615 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.73 164.46 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.037 0.446 . . . . 0.0 111.805 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.445 ' HA ' HD12 ' A' ' 578' ' ' LEU . 47.3 p -111.55 138.44 48.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.256 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.66 -89.88 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . 0.425 ' H ' ' HB ' ' A' ' 577' ' ' THR . . . -89.71 102.76 15.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 111.461 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.462 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.69 143.49 46.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.69 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.431 ' N ' ' HG2' ' A' ' 571' ' ' GLN . 24.6 p -129.92 -159.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.957 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.401 ' H ' ' HB ' ' A' ' 572' ' ' THR . 42.9 p -89.65 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.658 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.8 p -142.04 -50.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.791 0.329 . . . . 0.0 111.212 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -101.58 167.25 10.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.85 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.462 HG13 ' HB2' ' A' ' 571' ' ' GLN . 15.1 tt -155.92 147.42 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.425 ' HB ' ' H ' ' A' ' 570' ' ' ALA . 20.8 m -110.02 142.34 41.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.805 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.871 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.8 OUTLIER -132.89 133.4 43.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -127.55 139.95 52.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.507 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 45.0 p90 -154.39 169.68 23.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.3 m -81.5 138.15 35.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.335 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.39 171.84 8.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.223 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.601 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.9 OUTLIER -73.35 179.12 4.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.774 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -11.07 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.323 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -77.79 -63.98 1.26 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.051 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.8 m120 56.67 -161.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.774 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t 52.95 25.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.128 0.489 . . . . 0.0 110.655 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.97 -30.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.991 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.402 HG22 ' OD1' ' A' ' 628' ' ' ASP . 33.5 t -66.83 138.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.709 0.29 . . . . 0.0 110.508 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -107.55 -65.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.629 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -136.42 -164.79 10.33 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.31 -0.947 . . . . 0.0 113.251 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . 0.423 ' HB2' ' HZ2' ' A' ' 580' ' ' TRP . 95.3 m-85 -135.25 138.86 43.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.738 0.304 . . . . 0.0 111.009 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.14 119.22 38.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.414 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.2 137.78 25.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -104.13 147.76 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.726 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -109.05 84.15 1.87 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.323 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.5 -77.78 1.98 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -142.56 12.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.995 0.426 . . . . 0.0 111.138 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -132.69 174.51 10.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.382 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.95 133.91 34.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.77 0.319 . . . . 0.0 110.516 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.21 -108.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.692 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.4 t -91.79 171.83 8.88 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.303 0.573 . . . . 0.0 111.813 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.6 124.66 27.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.913 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.6 m -121.67 175.02 5.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.928 0.394 . . . . 0.0 112.027 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.504 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -132.56 -14.87 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.942 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -95.94 -108.98 2.42 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.597 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.72 -29.49 1.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.569 0.223 . . . . 0.0 111.489 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.537 ' O ' HG11 ' A' ' 604' ' ' VAL . 2.4 p -88.32 -177.04 5.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.188 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.671 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -160.68 133.04 6.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.977 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.2 m -119.01 110.35 17.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.072 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.414 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.8 mp -103.48 124.34 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.825 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 70.3 m -109.06 168.09 9.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 79.89 52.21 4.76 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.666 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 17.2 mt -118.13 165.75 13.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -127.44 131.93 50.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -68.53 176.32 2.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.285 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 59.43 22.25 10.72 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.44 151.32 44.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.364 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 67.6 m -92.37 146.1 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.325 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -139.6 128.88 23.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.91 0.385 . . . . 0.0 111.702 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.03 134.99 46.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.835 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -128.65 163.42 25.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.373 0.606 . . . . 0.0 112.159 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.1 p -147.54 164.8 32.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.83 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.471 HG23 ' CB ' ' A' ' 637' ' ' SER . 0.0 OUTLIER -135.01 142.46 40.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 111.548 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.7 mttt -131.25 162.87 29.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.737 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.9 132.46 55.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.179 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -123.65 154.6 39.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.402 ' OD1' HG22 ' A' ' 589' ' ' VAL . 0.6 OUTLIER -115.45 -179.91 3.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.894 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.95 -3.41 57.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -100.21 -0.09 39.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.025 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.27 35.25 15.12 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.652 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.468 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.5 m-80 -116.32 132.92 56.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 0.0 110.919 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.8 p -120.2 147.19 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.094 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.41 -152.05 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.579 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.521 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.35 174.15 7.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.967 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.493 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.13 130.74 36.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.124 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.471 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -67.99 -178.71 1.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.76 150.48 36.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.749 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -90.07 125.08 35.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.507 ' HB ' HD23 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -102.39 150.63 6.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.774 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.83 125.97 54.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 6.4 p -127.4 134.99 64.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.934 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.1 111.84 24.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.934 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 120.654 0.264 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.555 ' HB3' HG22 ' A' ' 589' ' ' VAL . 57.2 Cg_endo -70.68 -152.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.508 2.138 . . . . 0.0 112.134 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -116.55 125.72 52.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.927 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.503 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.19 124.22 73.54 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.942 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.47 144.52 7.11 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.466 2.111 . . . . 0.0 112.105 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 51.2 p -132.66 155.44 48.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.401 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t30 58.76 64.46 1.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.447 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.0 tp -88.3 156.71 19.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.233 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.666 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.13 172.38 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.961 0.41 . . . . 0.0 111.589 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.464 ' HA ' HD12 ' A' ' 578' ' ' LEU . 40.1 p -118.18 128.96 55.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.354 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.9 p -99.87 -87.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.521 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.44 96.66 10.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 111.438 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.585 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.9 tt0 -112.26 136.32 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.771 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.7 p -130.66 -162.14 1.19 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.096 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.4 p -91.86 6.66 45.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.451 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.449 ' O ' HD12 ' A' ' 614' ' ' LEU . 77.0 p -135.95 -56.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.24 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.573 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 10.9 t -113.91 158.45 21.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.585 HD12 ' HG3' ' A' ' 571' ' ' GLN . 15.4 tt -142.0 136.33 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 1.7 m -99.72 129.55 45.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.646 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -119.08 133.15 55.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.097 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 84.8 p -125.7 146.95 49.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.291 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.424 ' HB3' HD12 ' A' ' 566' ' ' LEU . 49.1 p90 -159.2 170.33 22.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.936 0.398 . . . . 0.0 111.379 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.33 133.18 36.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -71.0 174.66 5.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.07 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 t -83.2 149.37 26.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.877 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 3.9 p -75.43 -7.7 54.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 589' ' ' VAL . 72.9 m-20 -125.25 67.83 1.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.738 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.77 3.91 13.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.96 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.64 -12.22 15.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.047 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.75 -32.14 0.57 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.543 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.555 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.1 t -61.13 150.39 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.733 0.302 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.11 -50.6 1.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.426 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -147.3 175.15 26.81 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.813 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -122.59 157.86 31.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.794 0.33 . . . . 0.0 110.978 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.68 120.88 16.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 623' ' ' THR . 0.2 OUTLIER -101.25 137.16 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.955 0.407 . . . . 0.0 110.731 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 59.2 m-85 -104.07 147.85 26.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.75 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -99.69 84.29 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.132 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 88.11 -62.26 3.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.125 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.4 -20.7 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.994 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -96.07 163.63 13.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.915 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -80.05 118.14 21.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.722 0.296 . . . . 0.0 110.465 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -90.09 -106.38 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.939 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.0 t -91.1 167.68 12.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.103 0.477 . . . . 0.0 111.358 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.31 130.02 38.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.214 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.823 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.2 m -131.79 -178.8 2.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.581 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 65.6 p -135.67 -17.09 1.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -94.83 -139.08 9.8 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.01 16.92 19.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.291 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -133.89 170.38 15.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.053 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.823 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -148.55 140.93 24.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.849 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -125.95 113.13 16.76 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.476 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.573 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -110.39 108.36 25.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.788 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.8 166.8 10.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.967 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 82.48 32.42 27.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.437 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 574' ' ' SER . 10.8 mt -92.83 166.95 12.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.857 0.36 . . . . 0.0 111.097 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -116.36 147.08 41.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.744 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -78.18 162.09 26.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.506 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 58.43 38.02 25.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.408 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.48 147.01 38.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.348 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.17 144.04 28.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.55 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -137.86 153.4 49.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 111.767 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.538 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -125.02 139.44 53.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.098 179.169 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.465 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 44.9 m-85 -132.75 152.07 51.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 112.327 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 45.4 p -146.57 128.51 15.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.659 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.516 HG22 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.53 147.47 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 1.8 mttt -132.43 169.8 16.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.499 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.08 130.88 48.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.867 0.365 . . . . 0.0 111.379 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -121.02 147.15 45.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.723 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.37 171.93 7.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.06 40.5 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.198 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -139.9 -41.44 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.076 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 142.1 -9.27 2.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.643 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -83.1 137.64 34.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 111.033 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -129.74 148.61 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.931 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.99 -164.11 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.503 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.08 178.01 6.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.024 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -85.69 149.37 25.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.414 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -82.61 -175.8 5.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.896 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -62.2 160.84 12.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.2 131.65 39.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 621' ' ' THR . 13.6 p -115.59 134.05 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 8.3 t -104.99 130.24 53.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -117.05 150.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.973 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.64 88.74 2.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.121 -179.986 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 120.49 0.186 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 628' ' ' ASP . 70.0 Cg_endo -73.41 -178.77 3.88 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.442 2.095 . . . . 0.0 112.319 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.61 154.71 36.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.69 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -91.86 129.97 40.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.334 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.47 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 77.3 Cg_exo -50.12 151.4 9.1 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.511 2.141 . . . . 0.0 111.749 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 45.5 p -139.19 156.89 46.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 111.693 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.54 54.19 5.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.779 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.831 HD11 ' HG ' ' A' ' 578' ' ' LEU . 16.5 tp -82.38 156.27 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.682 0.277 . . . . 0.0 110.302 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.543 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.04 179.66 7.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.998 0.428 . . . . 0.0 111.67 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 93.2 p -126.75 123.17 36.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.178 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.6 -87.27 0.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.846 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -79.78 97.9 6.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.7 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -113.33 119.48 37.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.528 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 11.6 p -113.77 -161.02 0.75 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.006 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 30.1 p -91.46 20.55 5.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -167.68 -46.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.736 0.303 . . . . 0.0 111.405 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -105.77 130.69 53.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.216 -179.682 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.1 tt -121.05 147.34 24.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.214 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 31.8 m -111.65 131.38 55.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.698 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.831 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.5 tp -121.66 130.44 53.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 11.1 t -126.76 136.59 52.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.68 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.61 ' HH2' HG21 ' A' ' 604' ' ' VAL . 40.9 p90 -150.98 170.41 19.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.837 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.8 m -79.39 127.35 31.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -61.7 133.31 55.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.1 m -72.04 151.92 42.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -177.51 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 49.6 m-20 54.63 53.4 10.69 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.92 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -65.76 -10.33 36.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.882 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.5 m -66.68 -10.22 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.258 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -125.28 -34.8 0.65 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.552 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 627' ' ' LYS . 2.8 t -65.7 130.27 30.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 111.048 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.01 -23.06 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.181 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -175.9 178.22 47.44 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.65 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -126.03 126.31 44.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.826 0.346 . . . . 0.0 111.014 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.75 118.7 37.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.54 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.81 130.62 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.5 m-85 -99.67 154.51 18.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.677 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -136.47 90.22 2.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.499 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 70.19 59.55 5.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.148 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.6 p 53.58 40.49 31.49 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.962 0.41 . . . . 0.0 111.393 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.84 111.44 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.907 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -48.6 124.28 8.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.336 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -100.75 -106.39 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.081 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.5 t -91.02 167.67 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.139 0.495 . . . . 0.0 111.525 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 6.6 m -131.78 129.02 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.376 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.688 HG11 ' HA ' ' A' ' 609' ' ' ALA . 14.9 m -130.32 -170.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.528 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.606 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.9 p -145.65 -26.69 0.46 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.97 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -79.03 -113.42 0.22 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.913 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 7.4 p -139.14 3.65 2.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.736 0.303 . . . . 0.0 111.241 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.573 ' O ' HG11 ' A' ' 604' ' ' VAL . 41.1 p -129.46 146.34 51.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.688 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -124.06 136.02 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.031 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.34 129.47 54.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.7 mp -125.45 119.53 55.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.065 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.99 131.44 55.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.007 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 115.99 60.1 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.625 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.5 mt -129.61 173.89 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.724 0.297 . . . . 0.0 110.698 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -132.3 145.01 50.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.74 173.31 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.172 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 55.34 38.17 29.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.64 161.43 36.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.399 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 m -119.99 127.46 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.591 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -123.89 149.49 45.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.997 0.427 . . . . 0.0 111.215 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 44.5 p -124.3 106.13 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.395 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.415 ' CE1' HD13 ' A' ' 611' ' ' ILE . 94.5 m-85 -100.0 157.75 16.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.212 0.53 . . . . 0.0 111.749 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.5 p -152.38 134.66 15.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.731 179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.724 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.37 141.1 17.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.277 0.561 . . . . 0.0 111.975 -179.158 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.596 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -130.03 152.21 49.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.551 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.604 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -110.15 144.26 39.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.466 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -122.12 176.71 5.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.543 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.647 ' HB3' ' HD3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -138.45 172.15 13.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.84 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.82 42.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.368 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -150.16 -6.69 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.165 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 93.13 35.52 6.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.444 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -119.17 138.91 52.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 35.5 m -114.65 151.6 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.604 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 0.7 OUTLIER -90.33 -157.78 0.5 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.394 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.69 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.76 156.96 18.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.791 0.329 . . . . 0.0 110.652 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.596 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.05 116.01 19.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.821 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.413 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -56.84 173.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.162 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -58.03 147.49 29.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.45 139.92 36.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.076 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.6 m -116.51 103.57 15.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.968 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 14.5 t -83.6 106.32 15.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.862 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.432 HG11 ' CD1' ' A' ' 576' ' ' ILE . 10.9 p -109.07 145.12 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.157 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 644' ' ' THR . 0.2 OUTLIER -120.29 111.49 17.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.722 179.73 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . 0.458 ' O ' ' HE2' ' A' ' 643' ' ' LYS . 69.6 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.259 -0.876 . . . . 0.0 111.18 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.469 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.569 0.223 . . . . 0.0 111.018 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.81 -163.97 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.54 2.16 . . . . 0.0 112.343 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 583' ' ' SER . 5.0 m -100.29 124.63 45.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.101 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.434 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -62.97 129.65 93.48 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.486 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 85.0 Cg_exo -45.78 151.89 1.18 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.911 2.407 . . . . 0.0 112.295 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.2 p -136.17 155.49 50.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.9 0.381 . . . . 0.0 111.534 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 59.5 t30 57.23 67.47 0.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.576 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.856 HD11 ' HG ' ' A' ' 578' ' ' LEU . 15.2 tp -86.69 159.31 19.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.0 179.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.561 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.89 167.37 26.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.985 0.421 . . . . 0.0 111.888 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 4.6 p -121.23 146.65 46.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.334 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.1 p -125.98 -86.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.446 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 576' ' ' ILE . . . -82.15 97.93 8.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.194 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.98 95.28 4.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -84.45 -154.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.185 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.49 -11.55 39.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.69 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.7 p -136.82 -40.18 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.64 162.45 13.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.176 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -156.46 149.32 10.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.862 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.424 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.4 m -119.04 140.06 50.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.75 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.856 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -124.06 149.65 45.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.86 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 9.7 t -142.74 131.27 22.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.211 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.502 ' HB3' HD12 ' A' ' 566' ' ' LEU . 43.5 p90 -149.56 169.65 20.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.204 -179.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 m -79.89 143.61 34.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.961 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.44 170.18 0.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.442 ' O ' ' HB ' ' A' ' 561' ' ' THR . 2.2 p -69.87 -5.4 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.53 16.45 5.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -152.49 72.11 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.675 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.503 ' HB2' ' H ' ' A' ' 587' ' ' VAL . 0.2 OUTLIER -70.24 -128.87 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.721 -179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.503 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 4.2 m 44.1 26.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.119 0.485 . . . . 0.0 111.723 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -176.87 -37.62 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.918 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.67 144.4 13.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.564 0.221 . . . . 0.0 110.559 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.3 t -132.43 -30.11 1.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.748 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.49 172.41 30.98 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.011 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -130.93 134.87 47.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.691 0.281 . . . . 0.0 110.647 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -99.99 128.45 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.796 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.404 ' HB ' HG22 ' A' ' 602' ' ' THR . 61.6 t -99.66 132.51 44.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.979 0.419 . . . . 0.0 111.308 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.447 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 52.2 m-85 -101.31 124.66 47.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.928 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.497 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 47.6 t30 -100.06 84.61 2.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.92 -80.8 0.79 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.277 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 4.5 p -147.18 16.98 1.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.783 0.325 . . . . 0.0 111.072 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -145.35 173.05 12.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.57 HD22 ' H ' ' A' ' 601' ' ' ALA . 1.4 tm? -71.07 149.93 46.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.825 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.57 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -132.92 -100.94 0.26 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.342 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 594' ' ' VAL . 14.0 t -90.13 172.65 8.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.916 0.388 . . . . 0.0 111.428 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 80.1 m -140.34 126.07 19.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.858 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 609' ' ' ALA . 7.0 m -126.36 -177.09 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.528 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.748 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 67.4 p -137.89 -11.34 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.27 -126.52 5.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.464 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 4.4 p -122.72 -4.39 8.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.749 0.309 . . . . 0.0 111.059 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.465 ' O ' HG11 ' A' ' 604' ' ' VAL . 17.2 p -111.23 173.59 6.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.024 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -155.45 127.74 7.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.075 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.9 m -114.14 112.91 23.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.157 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.9 mp -105.94 131.9 54.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.937 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 15.9 p -120.89 173.73 7.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.106 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 74.8 44.47 24.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.727 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.3 mt -117.7 132.52 56.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.818 0.342 . . . . 0.0 110.825 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.02 143.88 35.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.96 167.38 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.21 35.06 25.72 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.8 m -137.51 146.43 44.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.232 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.83 136.88 32.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -135.76 140.36 44.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 111.615 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.559 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 2.0 p -111.97 135.02 53.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.532 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.635 ' H ' HG12 ' A' ' 640' ' ' VAL . 54.5 m-85 -126.45 161.27 28.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.279 0.562 . . . . 0.0 112.396 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.529 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.26 159.11 31.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.768 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.415 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -124.14 152.61 29.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.047 0.451 . . . . 0.0 111.497 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.551 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 3.8 mttt -139.15 139.36 37.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.803 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.533 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -94.96 116.42 28.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.0 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -108.71 148.59 30.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.104 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -116.19 169.92 8.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.773 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.64 -13.84 59.62 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.159 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -83.8 5.62 24.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.046 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.03 2.86 90.68 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.404 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 34.3 m-20 -95.81 123.47 39.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.761 0.315 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.5 p -120.91 136.79 56.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.533 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 1.9 p -69.03 -167.51 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.952 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.434 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.3 -178.46 5.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.751 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.551 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.16 146.0 28.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.6 p -82.64 -164.13 0.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.7 146.63 54.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.617 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.69 148.68 31.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.916 0.388 . . . . 0.0 111.163 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.635 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -114.7 158.46 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.767 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 44.7 t -143.94 105.52 4.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.769 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.87 140.01 48.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.098 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.09 102.02 9.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.672 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.139 -179.851 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 560' ' ' PRO . . . . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.529 0.204 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 559' ' ' ALA . 39.3 Cg_endo -65.48 -169.06 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.603 2.202 . . . . 0.0 112.396 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.95 118.12 28.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.126 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.599 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -60.17 127.29 85.84 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.406 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 88.4 Cg_exo -46.87 156.66 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.701 2.267 . . . . 0.0 112.034 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.52 159.32 40.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.449 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 60.0 49.94 7.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.287 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.841 HD11 ' HG ' ' A' ' 578' ' ' LEU . 56.9 tp -74.07 159.67 32.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.424 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.451 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -161.33 -176.81 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.435 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 35.3 p -133.89 130.59 38.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.332 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.5 p -104.09 -85.29 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.454 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.81 103.56 14.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.05 116.94 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.809 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -108.68 -161.43 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.081 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.54 16.98 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.452 ' O ' HD12 ' A' ' 614' ' ' LEU . 1.8 p -161.63 -43.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.186 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.7 167.11 10.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.633 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.5 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.3 tt -160.44 147.31 5.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.907 0.384 . . . . 0.0 111.27 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.4 m -116.55 134.41 54.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.642 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.841 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -118.76 133.94 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.082 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.32 132.98 48.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.431 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.621 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.8 p90 -148.29 169.74 19.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.175 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 7.2 m -81.32 115.57 20.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.979 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . 0.74 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -60.1 154.24 19.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.329 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 84.0 p -61.28 132.96 55.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.894 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -19.91 61.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.222 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -89.38 53.58 2.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.453 ' C ' ' H ' ' A' ' 588' ' ' GLY . 42.0 p-10 -72.54 -150.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 71.53 -17.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -132.66 -26.8 0.63 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.88 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.401 HG13 ' O ' ' A' ' 627' ' ' LYS . 83.4 t -66.87 145.25 13.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.725 0.297 . . . . 0.0 110.81 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.4 -67.09 0.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.48 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -143.61 -173.06 14.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.931 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -125.84 130.85 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 110.876 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -110.26 120.75 43.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.662 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.68 136.16 32.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.906 0.384 . . . . 0.0 110.764 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -99.35 174.97 6.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.157 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -140.63 84.43 1.95 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.357 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . 0.461 ' O ' HG23 ' A' ' 598' ' ' THR . . . 86.06 -66.22 3.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.233 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.461 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -163.11 31.76 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.859 179.727 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.65 137.06 11.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.068 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 601' ' ' ALA . 1.0 OUTLIER -56.66 136.22 54.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.202 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.459 ' N ' HD13 ' A' ' 600' ' ' LEU . . . -109.74 -104.3 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.969 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.7 t -90.44 163.09 14.79 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.079 0.466 . . . . 0.0 111.344 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.5 m -126.95 131.55 51.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.616 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.786 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -135.71 -179.92 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.417 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.2 p -136.87 -5.79 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.45 -124.16 5.32 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.585 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.74 HG22 ' HB2' ' A' ' 582' ' ' ALA . 80.5 p -129.48 9.76 5.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.733 0.302 . . . . 0.0 111.063 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.542 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 23.2 p -136.47 138.84 41.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.194 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.786 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.47 155.86 36.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.2 m -129.76 125.3 35.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.16 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.5 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.5 mt -121.68 119.61 59.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -107.42 173.64 6.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.03 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.66 59.09 8.05 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.612 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 574' ' ' SER . 12.4 mt -119.01 114.03 21.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.713 0.292 . . . . 0.0 111.005 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -65.21 133.67 52.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.15 173.18 3.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.69 35.32 25.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.049 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.3 m -140.36 142.92 35.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.459 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 t -99.95 111.92 24.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -105.25 127.6 53.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.552 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.622 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.1 OUTLIER -104.44 109.87 21.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.255 179.122 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.405 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 71.5 m-85 -102.19 161.71 13.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.331 0.586 . . . . 0.0 112.222 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.4 p -150.83 148.87 29.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.524 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -110.14 151.64 12.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.052 0.453 . . . . 0.0 111.784 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.0 mttt -139.93 150.18 44.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.006 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.411 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -112.17 121.84 46.07 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.898 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 589' ' ' VAL . 0.0 OUTLIER -115.44 158.42 22.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.25 -179.558 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.03 171.12 8.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.75 60.53 5.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.108 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -158.92 -43.78 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.68 16.37 0.61 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.496 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -111.99 125.11 53.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.339 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 28.4 m -119.67 142.65 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.355 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 31.7 p -77.68 -172.68 2.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.766 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.599 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.01 167.95 20.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.843 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -87.3 128.99 35.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.066 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.444 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.5 t -65.7 179.49 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.61 157.6 26.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.727 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.622 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -89.24 138.5 31.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.16 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.02 108.63 25.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.044 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.08 111.77 17.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.38 129.04 74.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -101.82 115.79 31.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.125 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.744 0.307 . . . . 0.0 111.324 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.564 ' HB3' HG22 ' A' ' 589' ' ' VAL . 92.0 Cg_endo -78.32 -158.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.6 2.2 . . . . 0.0 112.42 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 5.3 m -114.31 125.32 53.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.995 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.563 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.2 122.88 66.79 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.04 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.454 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.0 Cg_exo -48.42 159.33 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.539 2.159 . . . . 0.0 112.109 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . 0.488 HG23 ' OG1' ' A' ' 581' ' ' THR . 0.0 OUTLIER -157.6 169.97 23.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.838 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 59.03 40.46 22.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.048 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.771 HD11 ' HG ' ' A' ' 578' ' ' LEU . 66.2 tp -66.79 157.41 32.97 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.725 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.405 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.36 -179.38 6.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.7 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 6.4 p -134.9 122.54 22.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.077 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.6 p -100.78 -88.2 0.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.745 0.307 . . . . 0.0 111.65 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.22 100.36 11.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.276 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.617 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.1 OUTLIER -118.48 114.15 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.745 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 13.2 p -100.77 -156.87 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.06 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.59 22.45 9.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.363 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 68.0 p -160.02 -49.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -113.28 131.08 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.024 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.617 HG13 ' HB2' ' A' ' 571' ' ' GLN . 17.2 tt -118.6 146.1 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.087 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 31.6 m -104.5 138.77 40.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.755 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.771 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -126.37 133.94 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.3 t -128.47 143.06 50.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.523 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.454 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 41.4 p90 -158.33 169.57 24.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.851 0.358 . . . . 0.0 111.169 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . 0.488 ' OG1' HG23 ' A' ' 564' ' ' THR . 73.5 p -80.08 114.51 19.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.162 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.9 158.76 6.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.149 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.26 147.55 44.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.96 -5.61 49.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 589' ' ' VAL . 96.2 m-20 -126.35 73.27 1.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.908 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -85.31 18.87 2.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.3 p -81.14 -15.06 12.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.37 -24.31 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.608 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.564 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.8 t -61.67 143.51 14.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.774 0.321 . . . . 0.0 111.207 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 4.7 t -113.48 -15.98 12.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 171.24 -174.54 44.91 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.718 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -131.04 128.85 41.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.075 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.754 ' HB3' HD21 ' A' ' 600' ' ' LEU . 4.2 m-20 -111.14 117.8 34.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.552 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.34 139.0 22.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.999 0.428 . . . . 0.0 111.103 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.437 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.2 m-85 -99.4 150.29 22.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.231 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.405 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 2.9 t-20 -113.7 84.53 2.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.961 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.82 -65.45 1.19 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.093 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -154.74 -27.04 0.12 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.755 0.312 . . . . 0.0 111.152 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -100.01 153.07 19.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -58.25 131.34 50.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.937 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -101.35 -105.96 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.552 HG23 HG13 ' A' ' 594' ' ' VAL . 3.8 t -90.49 166.68 13.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.954 0.407 . . . . 0.0 111.416 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . 0.478 HG23 ' OD1' ' A' ' 593' ' ' ASP . 53.9 m -130.32 124.32 32.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.856 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.2 m -130.59 -177.68 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.293 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.475 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 50.6 p -142.4 -0.86 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -111.79 -144.78 9.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.669 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.6 25.1 11.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.752 0.31 . . . . 0.0 111.168 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -147.27 162.58 38.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.856 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.6 149.99 36.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.737 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 5.1 m -132.45 118.01 18.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.535 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -99.55 136.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.692 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 -172.21 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.962 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.21 -103.29 0.77 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 574' ' ' SER . 1.1 mp 57.86 177.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.027 0.442 . . . . 0.0 111.537 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -169.82 129.22 0.96 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.927 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -55.12 163.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.4 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.54 31.96 21.61 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.234 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.2 148.17 41.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.904 0.383 . . . . 0.0 111.432 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.49 140.13 38.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.515 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -134.89 130.18 35.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.315 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 38.3 p -105.39 108.33 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.149 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -99.9 160.2 14.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.272 0.558 . . . . 0.0 112.085 -178.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.3 p -154.08 136.07 14.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.814 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.564 HG23 ' HB2' ' A' ' 637' ' ' SER . 0.0 OUTLIER -99.41 151.94 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.012 0.434 . . . . 0.0 111.661 -179.346 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 8.4 mmtt -140.42 134.03 30.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.095 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.493 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -92.77 123.41 36.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -117.98 143.86 46.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.041 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -110.5 160.05 16.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.859 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.31 57.59 4.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.093 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.401 ' HB3' ' OD2' ' A' ' 628' ' ' ASP . . . -157.96 -39.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 133.44 32.35 0.39 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.732 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -122.53 100.62 7.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.784 0.326 . . . . 0.0 111.061 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.3 t -99.87 119.02 47.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.493 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 24.8 p -67.29 -173.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.979 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.563 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.97 166.4 21.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.274 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.38 142.7 32.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.564 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -74.65 175.55 7.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.044 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . 0.565 HD21 ' H ' ' A' ' 566' ' ' LEU . 3.7 p30 -60.29 150.94 28.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.592 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.87 137.57 36.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -116.94 112.31 38.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.913 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 15.2 t -89.15 109.34 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.0 144.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.84 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.845 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.135 -179.988 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.524 0.202 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -68.52 -169.82 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.407 2.071 . . . . 0.0 112.354 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 59.2 m -87.19 120.29 28.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.691 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.15 129.55 93.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.107 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.01 160.61 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.681 2.254 . . . . 0.0 112.173 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.0 t -145.47 163.69 33.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.309 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 59.68 34.27 22.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.715 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.643 HD21 HD22 ' A' ' 578' ' ' LEU . 2.3 tm? -62.95 119.53 9.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.258 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.41 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -147.61 152.08 37.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 111.334 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.1 p -93.78 137.76 32.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.2 p -107.49 -87.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.53 108.38 19.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.885 179.65 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.548 ' NE2' HG13 ' A' ' 642' ' ' VAL . 1.0 OUTLIER -123.03 134.55 54.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.141 -179.89 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.453 ' HB ' ' H ' ' A' ' 573' ' ' THR . 25.5 p -108.49 -157.2 0.61 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.453 ' H ' ' HB ' ' A' ' 572' ' ' THR . 0.6 OUTLIER -91.38 -12.23 35.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.324 -179.813 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.422 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.0 p -130.62 -44.87 1.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.298 -179.772 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -101.47 170.78 7.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.03 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.476 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.3 tt -160.44 146.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 87.8 m -118.41 114.04 22.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.824 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.643 HD22 HD21 ' A' ' 566' ' ' LEU . 9.3 mt -101.69 137.76 39.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.068 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 24.5 p -125.59 143.84 50.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.437 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.472 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -155.32 169.72 23.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.365 . . . . 0.0 111.124 -179.704 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.63 139.26 32.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.36 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.63 179.17 2.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.217 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 t -80.92 138.61 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 53.3 p -74.07 -1.14 18.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.657 ' HB3' HG22 ' A' ' 587' ' ' VAL . 0.8 OUTLIER -105.34 -67.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.809 179.868 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 46.7 t30 56.79 24.24 8.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 585' ' ' ASP . 2.3 m -89.29 27.06 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.039 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . 167.34 -9.33 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.41 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 3.6 t -66.46 153.65 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -52.17 0.76 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.419 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.665 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -134.98 179.9 17.18 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.813 -179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -134.75 121.62 20.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.614 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -100.89 126.2 47.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.6 179.757 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.66 142.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.924 0.393 . . . . 0.0 111.266 -179.495 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.577 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 81.0 m-85 -106.0 151.73 24.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.317 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -140.7 97.19 3.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.039 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 56.9 71.59 0.71 Allowed Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.627 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.2 p 47.62 31.07 1.93 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.813 0.339 . . . . 0.0 111.571 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.99 110.3 2.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.775 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.614 HD11 ' HB3' ' A' ' 593' ' ' ASP . 1.6 tt -52.22 133.92 33.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.332 -179.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.98 -100.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.868 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.468 ' O ' HG13 ' A' ' 594' ' ' VAL . 14.4 t -90.84 167.53 12.38 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.201 0.524 . . . . 0.0 111.436 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.6 m -135.33 117.24 15.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.522 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 609' ' ' ALA . 18.6 m -117.65 -172.55 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.636 -179.437 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.665 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 6.1 p -143.23 -2.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.14 -117.66 4.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.479 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -16.77 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.696 0.284 . . . . 0.0 111.315 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.487 ' O ' HG11 ' A' ' 604' ' ' VAL . 74.5 p -108.02 167.87 9.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.942 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.681 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.32 128.23 10.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.046 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.4 m -108.66 119.51 39.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.272 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.476 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.5 mp -108.48 138.21 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.3 p -121.13 175.59 6.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.898 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.09 61.51 5.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.667 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 574' ' ' SER . 9.5 mt -131.2 124.78 31.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 110.816 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -77.5 140.21 39.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.98 164.55 26.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.167 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.06 44.59 25.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.057 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.6 m -139.98 149.78 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -86.17 134.65 33.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.549 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -132.75 152.77 51.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.215 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -137.75 104.68 5.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.202 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.514 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 78.5 m-85 -100.52 176.49 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.292 0.568 . . . . 0.0 112.12 -178.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -173.73 168.72 4.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.71 179.641 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.472 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -131.16 151.36 35.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.068 0.461 . . . . 0.0 111.634 -179.899 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.531 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 8.9 mmtt -140.7 123.24 16.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.151 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.46 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -79.42 132.88 36.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.096 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -119.97 144.99 47.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.779 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -107.57 166.83 10.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.127 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.24 34.65 0.74 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.191 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.517 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -140.11 4.74 2.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.058 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.93 30.99 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.773 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -114.84 124.74 52.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.665 0.269 . . . . 0.0 110.788 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 12.4 p -116.45 134.53 59.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 111.244 179.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.46 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 21.4 p -76.89 -166.11 0.64 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.707 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.691 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -87.69 173.03 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.895 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.531 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -86.49 133.88 33.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.2 -179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.463 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -63.46 178.74 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.922 179.783 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.01 149.23 19.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.384 179.601 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.64 129.0 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.429 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.514 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.9 p -108.38 140.73 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.95 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.52 102.87 12.23 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.396 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.548 HG13 ' NE2' ' A' ' 571' ' ' GLN . 47.2 t -99.31 114.33 37.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.248 -179.494 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.07 101.07 10.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.613 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 68.3 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.201 -179.822 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.669 0.271 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.32 -159.72 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.457 2.105 . . . . 0.0 112.101 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.1 134.59 52.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.208 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.56 128.82 93.85 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.483 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 83.3 Cg_exo -45.23 136.65 10.88 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.697 2.265 . . . . 0.0 112.074 179.578 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.9 p -119.05 149.67 41.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.7 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 10.0 m120 55.94 61.96 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.483 179.468 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.52 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 33.1 tp -65.71 159.17 25.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.298 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.52 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.03 177.24 10.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.035 0.445 . . . . 0.0 111.636 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . 0.468 ' HB2' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -133.6 150.74 51.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.465 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -120.52 -90.35 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.447 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.0 97.26 11.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.229 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.468 ' NE2' ' HB2' ' A' ' 568' ' ' SER . 1.5 mp0 -113.72 102.71 10.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.828 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 8.6 p -88.17 -162.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.239 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.65 19.0 7.89 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.661 -179.569 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 8.9 p -158.89 -44.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.79 0.329 . . . . 0.0 111.204 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 65.3 p -113.92 122.2 46.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.425 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.1 tt -109.17 138.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.168 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 14.3 m -112.9 116.11 29.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' A' ' 568' ' ' SER . 59.5 mt -103.73 156.5 17.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.947 0.403 . . . . 0.0 111.182 -179.702 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.1 p -145.0 138.91 27.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.04 179.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -144.8 169.83 17.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.971 0.415 . . . . 0.0 111.52 -179.34 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -80.53 126.65 31.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.144 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.21 163.4 4.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.6 t -88.08 133.06 34.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -8.16 37.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.183 179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.1 54.98 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.958 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -71.15 -135.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.674 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.1 t 52.6 20.6 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 121.119 0.485 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -171.1 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.851 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 57.8 t -65.25 117.55 6.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.764 0.316 . . . . 0.0 110.422 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.0 t -101.06 -35.41 9.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.56 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -158.03 178.44 34.31 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.216 -0.992 . . . . 0.0 113.223 -179.616 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -124.94 155.13 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.763 0.315 . . . . 0.0 110.857 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -131.39 117.8 19.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.422 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.446 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.68 143.81 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.916 0.388 . . . . 0.0 111.289 -179.575 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.56 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 92.1 m-85 -108.97 156.2 19.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.45 -179.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -118.19 84.04 2.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.152 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.51 -51.43 4.4 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.209 -179.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.11 -43.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 0.0 111.125 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -80.06 172.39 13.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.2 tp -90.79 126.98 36.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.322 179.198 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.43 -107.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.859 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.413 HG22 HG13 ' A' ' 611' ' ' ILE . 2.9 t -91.54 164.95 13.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.216 0.532 . . . . 0.0 111.495 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -131.06 106.74 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.332 179.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.694 HG11 ' HA ' ' A' ' 609' ' ' ALA . 34.6 m -111.15 -177.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.638 -179.206 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.56 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.5 p -137.47 -20.08 1.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.795 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -81.15 -116.04 0.37 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.719 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.63 -5.12 2.88 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 -179.653 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.7 p -122.2 156.86 32.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.694 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -134.53 129.74 35.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.4 m -110.02 125.99 53.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.188 -179.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.9 mp -111.04 136.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.955 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 82.2 p -113.88 178.0 4.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.24 36.19 92.91 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.447 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.7 OUTLIER -87.88 -174.23 4.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 110.992 -179.903 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -147.29 158.04 43.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -88.91 157.32 18.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.213 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.66 43.37 28.22 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.089 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 10.7 m -140.31 144.13 36.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.457 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.9 p -90.58 140.48 29.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.262 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -135.12 122.66 22.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.828 0.347 . . . . 0.0 111.711 -179.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -102.88 105.51 15.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.91 178.852 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.409 ' O ' HG23 ' A' ' 623' ' ' THR . 74.1 m-85 -100.17 176.38 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.399 0.618 . . . . 0.0 112.442 -178.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -170.18 155.5 5.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.619 179.669 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.483 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -119.45 159.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.932 0.396 . . . . 0.0 111.538 -179.743 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.571 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.2 mmtt -140.75 113.34 8.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.211 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 633' ' ' VAL . . . -79.51 119.39 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.52 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.418 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -117.83 166.43 12.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.784 179.817 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.15 164.23 20.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.61 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.63 57.38 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.97 -19.02 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.082 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 113.09 26.15 4.18 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.269 -179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.477 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 4.4 m120 -121.81 121.25 36.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.748 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 626' ' ' ALA . 2.3 p -138.91 134.59 42.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.225 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.19 -176.5 3.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.828 179.908 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.472 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -74.68 176.17 7.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.044 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.571 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -73.54 154.72 39.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.078 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.411 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.3 p -79.85 -163.27 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.758 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.79 146.99 41.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.98 23.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.928 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.5 p -102.9 134.53 43.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.262 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.5 m -109.32 105.92 15.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.337 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.24 130.32 63.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -96.45 121.66 38.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.102 -179.75 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.464 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.577 0.227 . . . . 0.0 111.108 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.22 -165.76 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.642 2.228 . . . . 0.0 112.237 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.33 150.69 19.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.765 179.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.595 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -84.11 125.95 71.19 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.416 -179.748 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -48.31 154.57 2.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.686 2.257 . . . . 0.0 112.009 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.26 163.08 33.95 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.07 0.462 . . . . 0.0 111.664 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.94 52.74 11.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.06 179.122 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.675 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 2.0 tp -74.23 156.95 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.051 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.675 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 -177.99 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.518 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 83.9 p -133.76 129.04 36.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.653 179.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 76.1 p -111.43 -72.53 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.383 -179.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.26 96.3 10.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.351 . . . . 0.0 110.905 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 576' ' ' ILE . 0.7 OUTLIER -123.39 105.64 9.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 17.0 p -85.69 -155.2 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.919 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.0 m -88.04 -37.34 16.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 16.0 p -115.0 -2.61 12.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.669 0.271 . . . . 0.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -133.99 165.41 25.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.954 179.969 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 571' ' ' GLN . 16.4 tt -160.06 148.71 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.526 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.9 m -132.66 124.03 27.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.659 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' A' ' 608' ' ' THR . 23.7 mt -107.47 153.28 23.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.398 . . . . 0.0 111.486 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.7 t -133.38 135.23 44.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.051 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.528 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -143.48 169.89 16.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.473 -179.268 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 m -82.05 115.87 21.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.213 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . 0.429 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -62.55 157.25 20.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.018 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.6 146.29 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.757 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 74.5 p -82.56 20.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.126 179.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.17 71.32 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.94 22.25 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -85.45 6.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -155.85 -25.67 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.401 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.8 t -66.26 140.53 19.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.83 0.348 . . . . 0.0 111.173 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 22.3 p -115.48 -51.49 2.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.17 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.564 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -144.24 179.55 21.45 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.597 -179.947 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -131.28 120.36 23.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 111.016 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.521 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -99.75 122.17 42.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.419 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -102.01 138.17 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.971 0.415 . . . . 0.0 111.267 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.719 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 96.1 m-85 -99.27 162.04 13.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.655 179.912 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -140.32 88.96 2.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 62.55 69.02 1.42 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.995 -179.463 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p 50.23 35.02 9.59 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.008 0.432 . . . . 0.0 111.115 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.31 102.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.775 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.71 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -48.87 122.99 6.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.291 -179.654 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -92.89 -98.95 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.198 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.8 169.07 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.133 0.492 . . . . 0.0 111.669 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.16 109.07 6.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.455 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.731 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -108.42 -170.59 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.789 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.564 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 32.0 p -140.51 2.47 1.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.834 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.1 -134.05 5.56 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.475 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.429 HG22 ' HB2' ' A' ' 582' ' ' ALA . 52.5 p -112.5 -4.03 14.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.768 0.318 . . . . 0.0 111.238 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.518 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.4 p -119.1 152.75 35.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.122 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.731 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.26 124.02 22.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 9.2 m -106.56 134.41 49.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.347 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.445 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.4 mp -121.01 138.6 50.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 14.1 m -117.76 162.36 18.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.793 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.49 79.1 0.22 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.321 -179.761 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 614' ' ' LEU . 1.2 tp -135.18 154.86 51.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 111.081 -179.755 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -92.05 163.36 14.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.059 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -89.52 156.9 18.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.912 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 2.6 p30 40.57 58.09 2.44 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.504 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . 0.446 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 3.6 m -134.29 148.68 50.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.077 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 78.9 p -87.06 130.21 34.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.746 179.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . 0.446 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 69.5 m-85 -134.63 135.21 41.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.959 0.409 . . . . 0.0 111.645 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 43.3 p -114.62 128.13 56.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.857 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.483 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 76.2 m-85 -120.08 168.94 10.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.458 0.647 . . . . 0.0 112.274 -178.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -167.42 152.67 7.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.314 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.56 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -118.97 155.86 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 112.266 -179.266 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.719 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 5.7 mmtp -140.77 142.68 34.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.757 -179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.54 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -101.33 128.2 47.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.489 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.52 140.29 50.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 179.65 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.61 167.99 9.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.75 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -66.36 -31.32 72.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.89 -179.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.2 10.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.569 -179.38 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 76.81 69.82 1.35 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.508 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 71.6 m-80 -148.2 124.04 10.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.685 0.278 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 25.7 m -112.59 139.44 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.044 0.45 . . . . 0.0 111.693 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.54 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 2.0 p -83.8 -164.93 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.248 179.592 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.595 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.94 161.33 23.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.73 0.3 . . . . 0.0 110.814 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.639 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -74.1 144.23 45.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.865 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.416 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -72.15 -163.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.19 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.27 142.09 34.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.844 179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.483 ' HA ' ' O ' ' A' ' 622' ' ' PHE . . . -79.65 116.22 19.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.065 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 621' ' ' THR . 11.6 p -101.03 131.82 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.129 -179.942 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 45.8 t -106.28 113.78 27.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.1 147.75 26.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.432 -179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -111.46 116.07 30.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.856 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.183 179.967 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.708 0.29 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -83.34 -158.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.731 2.288 . . . . 0.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 3.4 m -115.91 133.94 55.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.067 179.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.54 127.33 92.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.247 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.36 163.63 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.737 2.292 . . . . 0.0 112.003 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.2 t -155.07 158.43 39.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.366 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.2 m120 58.36 49.63 10.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.287 179.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.797 HD11 ' HG ' ' A' ' 578' ' ' LEU . 6.1 tp -71.16 158.49 36.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.306 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.641 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 174.51 13.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 0.0 111.475 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.9 142.8 50.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.619 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.13 -78.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.277 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . 0.532 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -88.67 96.53 10.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.186 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.03 97.6 6.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.92 179.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 61.1 p -92.63 -163.61 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 46.2 p -90.52 24.97 2.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.353 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 614' ' ' LEU . 24.9 p -163.83 -49.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.017 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -101.06 160.14 14.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.945 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.458 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.5 tt -151.18 137.08 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.926 0.394 . . . . 0.0 111.176 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . 0.532 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.8 m -106.17 131.36 53.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.567 179.63 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.797 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -120.81 128.24 52.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.532 -179.208 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.6 t -123.73 128.34 49.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.405 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.599 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.6 p90 -140.64 170.21 16.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.959 0.409 . . . . 0.0 111.456 -179.355 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.3 m -79.6 123.02 27.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.143 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.58 162.63 8.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.22 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 7.4 m -71.46 158.2 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 17.45 3.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.614 ' O ' HG23 ' A' ' 589' ' ' VAL . 1.6 t70 -138.5 44.22 2.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.799 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -60.79 -12.87 12.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.162 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.7 -9.92 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.041 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.0 -29.82 0.6 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.569 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 585' ' ' ASP . 7.4 t -65.31 145.48 13.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.644 0.259 . . . . 0.0 110.874 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.4 t -117.64 -34.32 4.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.477 -179.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.716 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -157.46 169.43 34.4 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.16 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -122.63 126.15 47.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.727 0.298 . . . . 0.0 110.763 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 1.3 m-20 -101.54 116.62 33.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.632 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.62 HG13 ' HB ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.32 139.95 19.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.982 0.42 . . . . 0.0 111.106 -179.599 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -102.21 146.58 27.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.278 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 0.2 OUTLIER -101.67 84.59 2.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.179 179.105 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.13 -55.82 4.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.349 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.5 p -147.56 -56.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.774 0.321 . . . . 0.0 111.033 179.86 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.69 174.12 11.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 154.15 25.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.906 0.384 . . . . 0.0 110.986 -179.944 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -141.08 -68.68 0.39 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.135 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.62 ' HB ' HG13 ' A' ' 594' ' ' VAL . 0.1 OUTLIER -90.76 154.88 19.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.133 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.23 89.34 2.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.423 178.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.808 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.9 m -104.03 -176.03 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.613 -179.322 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.716 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.6 p -144.41 -11.56 0.62 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.111 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -96.91 -137.67 9.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.628 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.89 10.05 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.641 0.258 . . . . 0.0 111.396 -179.828 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -137.11 165.55 25.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.315 -179.902 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.808 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -141.8 150.91 42.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.158 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.6 m -134.43 118.33 17.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.303 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.458 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.5 mp -117.88 111.81 35.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.0 154.01 21.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.988 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.64 33.64 5.53 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.601 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 574' ' ' SER . 3.6 mt -107.58 155.8 19.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.783 0.325 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.68 159.97 15.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.95 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.02 179.58 5.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.401 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.18 28.39 17.68 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.077 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.15 150.47 44.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.468 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 75.3 m -100.64 121.08 41.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.29 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -114.46 129.39 56.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.993 0.425 . . . . 0.0 111.897 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.5 OUTLIER -108.75 121.91 46.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.787 178.907 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.23 165.15 12.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.381 0.61 . . . . 0.0 112.395 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 7.0 p -150.44 149.99 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.709 179.27 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.599 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -117.01 152.78 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.955 0.407 . . . . 0.0 111.523 -179.769 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.7 mttt -140.62 139.79 34.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.204 -179.654 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -99.04 121.96 41.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.449 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.84 140.46 49.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.987 -179.813 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . 0.446 ' OD1' HG22 ' A' ' 589' ' ' VAL . 9.1 m-20 -105.2 175.01 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.893 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.95 15.29 4.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.293 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -113.26 6.45 17.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.976 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 80.11 9.9 86.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.475 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -102.14 125.38 48.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.89 137.94 56.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.093 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.1 -167.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.163 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.08 178.9 7.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.061 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.483 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.2 146.86 23.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.05 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.422 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.1 t -79.09 174.71 11.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -59.3 148.29 32.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.801 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -81.3 126.67 31.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.575 ' O ' ' HA ' ' A' ' 621' ' ' THR . 5.3 p -99.5 134.11 39.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.554 179.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.87 113.34 26.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 111.056 -179.398 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.409 HG21 ' CD1' ' A' ' 576' ' ' ILE . 0.4 OUTLIER -122.95 131.34 73.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.901 179.826 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.39 113.99 25.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.2 -179.93 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -68.5 -172.66 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.527 2.151 . . . . 0.0 112.311 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 18.2 p -99.93 135.45 41.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.405 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.419 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -64.12 132.24 95.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.128 179.769 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB2' ' HB2' ' A' ' 637' ' ' SER . 81.0 Cg_exo -45.47 153.74 0.63 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.616 2.21 . . . . 0.0 112.226 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.29 151.05 44.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.943 0.401 . . . . 0.0 111.62 -179.577 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 59.39 59.71 2.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.969 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.715 HD11 ' HG ' ' A' ' 578' ' ' LEU . 63.9 tp -74.83 159.95 31.28 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.417 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.34 173.35 15.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.021 0.438 . . . . 0.0 111.934 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.71 129.11 36.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.307 179.381 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.8 p -106.36 -84.23 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 111.643 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.8 96.92 10.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.461 -179.426 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.537 ' NE2' ' HA ' ' A' ' 644' ' ' THR . 1.8 tt0 -116.0 101.65 8.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.793 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.5 p -90.78 -157.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.072 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 40.5 p -95.24 25.21 4.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.465 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 78.8 p -167.36 -50.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.278 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.55 131.54 53.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.146 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.64 HD12 HG11 ' A' ' 642' ' ' VAL . 10.0 tt -121.99 143.31 35.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -107.15 117.01 32.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.579 179.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -108.63 134.99 50.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.149 -179.526 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -130.01 136.52 49.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.474 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.1 p90 -148.59 169.78 19.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.902 0.382 . . . . 0.0 111.122 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 5.5 m -82.14 116.52 21.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.963 179.684 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.25 155.25 21.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.048 179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 m -59.46 120.61 9.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.79 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -15.96 61.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.9 -66.14 0.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.865 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.484 ' O ' HG12 ' A' ' 587' ' ' VAL . 49.5 t30 57.71 -133.69 1.19 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.772 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.484 HG12 ' O ' ' A' ' 586' ' ' ASN . 3.8 p 45.1 23.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 111.655 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.44 -21.13 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.084 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.7 t -76.34 134.18 29.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.789 0.328 . . . . 0.0 110.713 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.89 -48.22 4.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.314 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.12 -179.35 26.77 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.87 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -126.42 132.5 51.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.36 123.19 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.389 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.86 137.57 26.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.889 0.376 . . . . 0.0 111.228 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.413 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 93.0 m-85 -99.47 145.39 27.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.513 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 2.9 t-20 -114.92 89.74 3.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.368 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.56 -70.9 3.02 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.129 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.5 p -148.11 -16.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.865 0.364 . . . . 0.0 110.888 179.73 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -115.53 134.75 54.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 179.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.403 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -48.35 147.67 2.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.345 -179.747 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.513 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -115.33 -106.65 0.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.173 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.5 t -90.92 168.07 11.96 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.205 0.526 . . . . 0.0 111.854 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -128.92 130.84 47.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.313 179.756 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.6 m -132.77 -177.7 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.501 -179.365 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.521 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 34.7 p -145.53 17.67 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.974 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -128.05 -121.85 2.44 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.761 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.95 9.3 5.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.627 0.251 . . . . 0.0 111.41 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.1 p -139.72 140.08 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.36 -179.879 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -122.48 148.0 45.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.5 m -122.01 109.08 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.278 -179.896 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.462 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -102.34 126.71 56.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.096 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 164.97 13.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.864 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.85 47.78 5.18 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.473 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.5 mt -119.38 152.25 37.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 110.918 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.7 152.12 35.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.151 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -77.93 174.91 10.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.4 t0 56.86 25.55 10.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.14 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.72 161.57 32.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.054 179.827 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 47.5 t -121.94 137.28 54.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.82 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -135.62 172.54 12.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.943 0.401 . . . . 0.0 111.491 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.55 110.65 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.105 179.496 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.408 ' O ' HG23 ' A' ' 623' ' ' THR . 78.6 m-85 -99.73 165.65 11.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.227 0.537 . . . . 0.0 111.959 -178.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.408 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.8 OUTLIER -159.62 153.07 22.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.882 179.628 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.474 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -118.57 150.12 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.924 0.392 . . . . 0.0 111.345 -179.763 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.413 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.3 mttt -136.0 150.16 49.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.083 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -106.26 129.27 54.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.223 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.637 ' HB3' HG12 ' A' ' 633' ' ' VAL . 1.9 ptmm? -127.78 142.62 51.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.28 169.72 8.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 179.848 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.62 48.7 1.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.74 3.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.084 179.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.84 61.81 1.74 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.458 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.8 m120 -145.48 106.98 4.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.646 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . 0.637 HG12 ' HB3' ' A' ' 627' ' ' LYS . 29.4 m -118.82 137.98 51.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.378 -179.823 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.419 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -87.95 -167.0 1.74 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.718 179.808 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -73.0 170.95 13.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.14 138.78 33.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.465 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.51 179.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.234 -179.847 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.24 148.44 27.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.69 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.97 128.39 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.003 -179.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.3 m -109.73 115.08 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.268 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 19.6 m -79.81 100.95 8.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.287 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.64 HG11 HD12 ' A' ' 576' ' ' ILE . 63.6 t -99.86 108.79 23.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.37 -179.458 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 95.0 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . 0.537 ' HA ' ' NE2' ' A' ' 571' ' ' GLN . 19.8 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.18 -179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.63 0.252 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.45 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.562 2.175 . . . . 0.0 111.958 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.831 HG23 ' HB2' ' A' ' 585' ' ' ASP . 2.2 p -107.52 136.88 46.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.889 0.376 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.423 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -67.18 129.9 93.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.305 -179.783 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.458 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 85.3 Cg_exo -47.28 152.48 2.21 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.729 2.286 . . . . 0.0 111.854 179.277 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.96 161.76 34.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.34 -179.652 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 61.1 34.05 19.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.938 179.639 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.779 HD21 HD22 ' A' ' 578' ' ' LEU . 1.6 tm? -69.15 117.51 10.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.117 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.494 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -144.74 145.97 31.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.232 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 2.1 p -84.83 150.74 24.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 179.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 6.2 p -124.29 -86.43 0.63 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.277 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.9 99.46 12.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.014 -179.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.485 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.6 tt0 -119.43 140.13 50.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.043 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 36.5 p -128.45 -167.85 1.83 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.895 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 6.1 p -87.38 32.98 0.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.189 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 23.2 p -169.46 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.315 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -110.69 135.97 50.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.248 -179.677 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.485 HD12 ' HG3' ' A' ' 571' ' ' GLN . 13.8 tt -127.71 139.32 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.78 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 20.7 m -110.27 122.2 47.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.135 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.779 HD22 HD21 ' A' ' 566' ' ' LEU . 13.1 mt -109.1 141.47 41.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.969 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.5 t -132.29 133.54 44.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.559 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -144.76 169.66 17.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.198 -179.599 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.7 m -84.69 128.25 34.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.199 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.24 25.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.047 179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 94.5 p -61.49 150.19 36.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.899 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 30.7 p -85.61 11.64 10.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.01 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.831 ' HB2' HG23 ' A' ' 561' ' ' THR . 0.4 OUTLIER -119.38 45.08 2.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.923 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.44 ' C ' ' H ' ' A' ' 588' ' ' GLY . 73.1 m-20 -65.11 -164.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.962 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 11.2 t 66.41 -4.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.118 0.485 . . . . 0.0 110.906 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -142.24 -16.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 585' ' ' ASP . 89.3 t -82.49 146.57 6.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.67 0.272 . . . . 0.0 110.781 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 591' ' ' GLY . 1.3 t -106.08 -54.41 2.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.638 -179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -151.71 -172.21 20.28 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.137 -179.563 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -131.01 129.26 41.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.791 0.329 . . . . 0.0 110.586 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.18 117.67 34.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.548 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.83 137.01 28.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.804 -179.892 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 33.9 m-85 -101.9 175.06 5.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.315 -179.444 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.45 HD21 ' HD1' ' A' ' 620' ' ' TYR . 6.7 t-20 -140.48 89.3 2.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.737 179.666 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 85.32 -68.84 3.38 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.305 -179.736 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.406 ' H ' ' H ' ' A' ' 599' ' ' ALA . 1.1 p -150.3 -18.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.902 0.382 . . . . 0.0 110.638 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . 0.406 ' H ' ' H ' ' A' ' 598' ' ' THR . . . -114.6 135.25 54.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.6 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.1 tp -51.94 144.22 12.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.218 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.44 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -110.96 -98.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.101 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.548 HG23 HG13 ' A' ' 594' ' ' VAL . 2.9 t -90.83 160.2 15.87 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.108 0.48 . . . . 0.0 111.645 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 15.9 m -125.97 122.62 36.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.167 179.551 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.755 HG11 ' HA ' ' A' ' 609' ' ' ALA . 30.1 m -127.83 -174.74 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.062 0.458 . . . . 0.0 111.998 -178.918 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.523 HG22 ' HA3' ' A' ' 591' ' ' GLY . 6.2 p -146.59 -2.29 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.889 179.843 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.49 -134.15 6.64 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.717 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.47 30.16 7.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.776 0.322 . . . . 0.0 111.242 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.489 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -157.77 141.17 15.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.215 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.755 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.78 155.97 36.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.81 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 16.6 m -137.06 124.51 22.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.241 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.449 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 4.7 mp -113.68 128.34 70.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.96 171.08 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 61.02 64.81 3.74 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.675 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.4 OUTLIER -115.51 132.44 56.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.828 0.347 . . . . 0.0 110.868 -179.989 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -99.44 134.72 41.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.116 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.12 168.23 16.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 16.2 t0 59.66 29.08 18.63 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.019 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.9 m -134.79 142.23 46.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.168 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 26.3 t -84.09 143.66 29.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.738 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . 0.45 ' HD1' HD21 ' A' ' 596' ' ' ASN . 59.8 m-85 -136.87 142.35 42.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.151 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.4 p -132.57 114.2 13.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.289 179.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.546 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 81.3 m-85 -109.13 166.88 10.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.283 0.563 . . . . 0.0 111.905 -179.203 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.2 OUTLIER -169.26 127.17 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.693 179.603 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.526 HG23 ' HG ' ' A' ' 566' ' ' LEU . 0.6 OUTLIER -99.36 149.55 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.491 . . . . 0.0 111.926 -179.056 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.1 mttt -128.24 166.36 18.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.332 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -116.06 123.78 48.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -121.38 154.44 36.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.829 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 171.74 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.57 47.69 1.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.361 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -153.92 -30.85 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.056 179.86 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 125.11 28.25 1.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.573 179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -112.7 120.29 41.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.77 0.319 . . . . 0.0 110.702 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.7 147.75 24.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.33 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.3 t -89.95 -154.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.524 179.68 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.423 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -84.0 -179.5 7.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 179.725 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.548 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.15 140.3 29.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.371 . . . . 0.0 111.023 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.458 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 4.9 p -68.45 -172.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.014 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.71 145.37 52.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.747 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.421 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -80.17 119.19 22.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.167 -179.902 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.3 p -101.12 123.95 54.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.041 179.855 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.3 t -105.58 106.14 16.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.862 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 620' ' ' TYR . 0.1 OUTLIER -113.36 125.45 70.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.259 179.991 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.92 101.68 12.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 70.9 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.254 -179.963 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.472 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.721 0.296 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.506 ' HB3' HG22 ' A' ' 589' ' ' VAL . 69.1 Cg_endo -74.09 -168.74 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.512 2.141 . . . . 0.0 111.817 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.765 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 70.2 m -109.81 113.27 25.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.173 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.33 64.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.737 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 86.4 Cg_exo -46.98 160.33 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.602 2.201 . . . . 0.0 112.381 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.8 t -155.28 157.81 37.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.555 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 11.3 t30 58.46 43.16 19.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.432 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.759 HD11 ' HG ' ' A' ' 578' ' ' LEU . 51.7 tp -61.45 160.58 10.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.303 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.441 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.21 173.7 14.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 111.774 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.6 p -126.13 136.31 52.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.6 p -110.65 -86.88 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.534 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.16 98.5 11.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.819 0.342 . . . . 0.0 111.348 -179.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.409 ' HB3' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.12 104.09 10.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.844 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.8 p -103.83 -170.08 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 71.5 p -91.74 41.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.6 p -168.65 -42.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.259 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -135.28 137.47 42.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.136 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.594 HG22 ' HB ' ' A' ' 611' ' ' ILE . 13.7 tt -118.67 142.48 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.247 179.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.5 m -110.82 121.63 45.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.622 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.759 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -111.36 136.08 51.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.085 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.3 t -130.94 135.38 47.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.613 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.4 p90 -143.71 170.18 16.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.985 0.421 . . . . 0.0 111.428 -179.334 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.45 116.65 19.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.019 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -60.74 170.06 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.266 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.765 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 2.6 p -88.33 138.91 31.02 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.996 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -13.94 62.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.337 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 589' ' ' VAL . 27.9 m-20 -110.03 59.23 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.846 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -78.24 5.2 10.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.2 p -67.57 -18.98 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.799 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -120.79 -24.98 2.43 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 179.901 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 560' ' ' PRO . 3.5 t -69.6 133.85 31.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.906 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.9 t -120.28 0.52 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.439 -179.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.644 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.63 162.81 23.61 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.253 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -122.05 145.56 48.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.811 0.338 . . . . 0.0 110.746 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.581 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -123.03 124.54 43.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.723 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.553 ' CG1' HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -101.18 132.6 46.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.035 0.445 . . . . 0.0 111.032 -179.942 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.743 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 97.3 m-85 -99.74 149.31 23.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.954 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -131.35 100.4 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.757 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.9 69.52 1.24 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.332 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 68.1 p 48.41 29.51 2.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.925 0.393 . . . . 0.0 111.353 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -154.8 103.75 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.599 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.743 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -48.47 139.4 9.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.526 -179.451 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.38 -94.65 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.792 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.553 HG23 ' CG1' ' A' ' 594' ' ' VAL . 0.9 OUTLIER -91.07 163.13 14.41 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.111 0.481 . . . . 0.0 111.443 179.83 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 99.57 4.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.421 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.73 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.2 m -103.16 -167.88 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.648 -179.203 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.644 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.0 p -143.51 -24.03 0.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.014 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -83.33 -124.6 0.98 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.618 -179.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 0.5 OUTLIER -126.21 9.54 7.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 111.12 -179.875 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.551 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -131.19 157.63 42.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.246 -179.998 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.73 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.46 142.7 30.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.583 179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.5 OUTLIER -125.24 131.2 53.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.557 -179.697 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.594 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.2 mp -115.83 130.39 70.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.131 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 3.2 p -99.37 -178.07 3.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.783 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 56.44 45.7 88.84 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.37 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 614' ' ' LEU . 6.1 tp -97.66 148.06 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 111.133 -179.769 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.74 165.55 13.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 174.04 7.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.362 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 43.32 44.04 4.49 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.946 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.16 151.55 45.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.281 179.53 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -108.63 132.54 53.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.536 179.618 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -126.6 136.87 53.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.91 0.386 . . . . 0.0 111.411 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.37 116.26 31.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.087 179.094 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -114.0 163.6 14.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.255 0.55 . . . . 0.0 112.233 -178.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -155.72 147.18 22.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.645 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.613 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -109.95 152.65 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -179.625 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.565 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 4.9 mmtt -135.79 145.68 46.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.089 -179.531 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.484 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -109.98 115.68 30.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.435 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 2.0 pttm -117.95 152.1 36.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.111 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -99.74 -159.3 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -51.56 -76.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.071 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.86 48.51 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.466 179.954 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -148.18 -66.06 0.01 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.42 -179.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 7.8 m120 -89.89 145.11 25.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.205 0.526 . . . . 0.0 111.811 -179.091 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.2 t -137.95 135.74 45.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 179.35 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 626' ' ' ALA . 0.6 OUTLIER -89.15 173.88 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.178 -179.513 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.444 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -82.39 171.65 13.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.212 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.484 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.14 143.36 32.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.1 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -174.45 3.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -70.55 152.0 44.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.562 179.744 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.71 149.42 29.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.026 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.12 111.05 23.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.373 -179.888 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.0 t -89.29 112.57 23.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.68 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.28 140.52 31.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.09 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.34 100.79 10.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.845 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.102 179.977 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.661 0.267 . . . . 0.0 111.347 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.418 ' HB2' ' H ' ' A' ' 561' ' ' THR . 86.9 Cg_endo -83.27 -140.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.695 2.263 . . . . 0.0 112.137 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.418 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -115.34 122.27 45.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.806 0.336 . . . . 0.0 110.853 179.661 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.16 129.88 86.55 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.282 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 87.7 Cg_exo -45.8 125.39 8.01 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.66 2.24 . . . . 0.0 111.887 179.561 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 2.8 t -109.53 149.83 29.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.637 -179.431 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 m120 57.41 78.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.796 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.513 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 36.9 tp -90.35 159.27 16.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.303 179.118 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.513 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.61 14.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.974 0.416 . . . . 0.0 111.649 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 77.6 p -124.65 143.26 50.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.326 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.31 -89.84 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.714 0.292 . . . . 0.0 111.77 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.71 103.15 11.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.602 -179.422 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.7 134.56 54.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.757 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.403 ' HB ' ' H ' ' A' ' 573' ' ' THR . 18.5 p -129.62 -161.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.793 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.403 ' H ' ' HB ' ' A' ' 572' ' ' THR . 16.7 p -96.77 27.49 3.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 88.5 p -168.65 -40.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.333 179.985 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -115.99 153.33 31.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.237 -179.651 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.4 tt -144.78 149.11 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.912 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 71.2 m -128.36 111.61 13.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 91.9 mt -100.45 141.46 33.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.102 -179.793 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 607' ' ' THR . 22.6 t -124.8 140.43 52.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.394 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.46 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 48.3 p90 -154.55 169.79 22.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.11 -179.568 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.4 m -84.55 122.38 28.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.862 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.17 160.49 3.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.147 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.2 m -56.72 158.91 4.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 32.2 p -96.97 12.79 31.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.573 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.469 ' OD2' HG23 ' A' ' 589' ' ' VAL . 5.8 p-10 -105.78 -57.98 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.143 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.409 ' N ' ' CG ' ' A' ' 585' ' ' ASP . 0.1 OUTLIER 48.98 24.13 0.82 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.783 0.325 . . . . 0.0 111.364 179.914 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 585' ' ' ASP . 12.5 m -98.31 -2.86 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.052 0.453 . . . . 0.0 110.995 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -165.0 -8.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.844 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.469 HG23 ' OD2' ' A' ' 585' ' ' ASP . 16.4 t -65.27 128.75 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.866 0.365 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.78 -30.5 5.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.277 -179.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.69 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -161.67 174.26 38.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.729 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -125.98 125.79 43.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.867 0.365 . . . . 0.0 110.905 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.504 ' OD1' HD11 ' A' ' 600' ' ' LEU . 2.3 m-20 -100.03 119.11 37.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.6 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.83 135.41 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.006 0.432 . . . . 0.0 111.185 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.697 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.2 m-85 -99.88 129.71 45.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.982 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 21.7 t30 -109.93 89.16 2.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.586 179.649 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 68.45 72.34 0.83 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 27.0 p 46.66 30.04 1.07 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.952 0.406 . . . . 0.0 111.334 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.07 106.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.763 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.697 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 7.7 tt -47.1 138.81 6.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.449 -179.641 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . 0.429 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -114.39 -92.11 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.0 179.816 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.6 t -90.69 168.01 12.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.256 0.551 . . . . 0.0 111.676 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 43.5 m -138.61 108.5 6.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.348 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.3 m -105.86 -168.17 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.351 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.69 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.4 p -143.06 -12.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.82 -135.49 8.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.549 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . 0.446 ' O ' ' HA ' ' A' ' 579' ' ' SER . 70.2 p -111.3 5.13 19.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.775 0.321 . . . . 0.0 111.238 -179.896 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 2.3 p -115.38 164.14 14.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.701 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -150.93 115.85 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.733 0.301 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.6 m -102.56 121.37 42.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.154 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.0 mt -120.7 121.77 66.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 -179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 80.2 p -101.01 174.6 5.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.774 179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.89 58.38 10.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.362 -179.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.1 OUTLIER -120.21 133.36 55.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.861 0.362 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -74.58 160.91 30.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.232 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.11 147.01 23.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 52.97 52.95 12.84 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.1 m -134.34 142.4 47.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.175 -179.791 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.8 t -79.72 137.44 37.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.45 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -139.17 134.61 33.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.476 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.459 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.84 113.48 23.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.043 179.119 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . 0.473 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 63.1 m-85 -108.14 160.77 15.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.355 0.598 . . . . 0.0 112.372 -178.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.86 130.36 8.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.834 179.557 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.48 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.1 OUTLIER -99.61 152.03 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.168 0.509 . . . . 0.0 111.724 -179.242 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.573 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 11.6 mttt -140.73 142.3 34.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.986 -179.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -102.19 122.92 45.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.127 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . 0.452 ' HD3' ' OD2' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -114.35 149.88 35.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 179.825 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -105.76 -179.17 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.2 37.14 0.89 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.864 179.77 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -144.23 6.3 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.62 16.45 70.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.457 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.49 111.59 24.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.746 0.308 . . . . 0.0 110.789 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 10.6 p -110.34 144.38 18.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.242 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.9 -162.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.012 -179.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.84 178.39 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.103 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.33 147.45 23.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.294 -179.818 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . 0.435 ' CB ' HG23 ' A' ' 624' ' ' VAL . 8.2 t -78.61 -177.11 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.755 179.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.09 142.71 58.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.535 179.682 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.459 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -79.93 120.01 23.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.955 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.527 HG22 HG13 ' A' ' 642' ' ' VAL . 7.5 p -100.26 126.88 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.186 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.32 93.17 4.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.479 179.801 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.527 HG13 HG22 ' A' ' 640' ' ' VAL . 15.5 m -99.72 155.45 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.238 -179.725 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.26 118.15 33.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.768 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.081 179.945 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.561 0.219 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.589 ' HB3' HG22 ' A' ' 589' ' ' VAL . 27.8 Cg_endo -62.9 175.85 2.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.44 2.093 . . . . 0.0 112.243 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 583' ' ' SER . 27.1 m -83.3 135.35 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.285 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.683 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -70.23 127.16 92.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.586 -179.774 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.44 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 60.4 Cg_exo -51.45 162.01 1.65 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.831 2.354 . . . . 0.0 111.838 179.261 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 8.1 t -159.56 169.41 23.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.279 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 57.82 33.79 23.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.348 179.653 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.83 HD11 ' HG ' ' A' ' 578' ' ' LEU . 53.9 tp -60.51 158.73 11.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.316 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.451 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.42 14.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.406 . . . . 0.0 111.553 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.9 p -129.43 127.48 41.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.372 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.57 -84.18 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.722 -179.53 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.71 97.0 9.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.44 -179.591 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.433 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.5 OUTLIER -118.63 106.41 12.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.718 179.703 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 39.3 p -95.65 -156.63 0.53 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.025 179.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.2 p -99.34 24.15 8.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.453 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.412 ' O ' HD12 ' A' ' 614' ' ' LEU . 87.4 p -163.95 -42.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.135 -179.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.515 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.7 OUTLIER -119.04 128.63 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.256 -179.661 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.47 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.4 tt -119.06 146.47 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 34.6 m -112.19 131.56 55.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.594 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.83 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -117.9 146.75 43.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.267 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . 0.487 ' O ' HD12 ' A' ' 566' ' ' LEU . 12.5 t -140.91 140.2 34.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.471 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.498 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -155.55 169.77 23.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.256 -179.596 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.9 126.17 32.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.119 179.905 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.77 5.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.157 -179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 561' ' ' THR . 3.3 p -72.62 157.49 37.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.7 -2.84 58.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 45.0 m-20 -123.18 54.39 1.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 -179.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . 0.552 HD22 ' HB ' ' A' ' 589' ' ' VAL . 17.6 t-20 -74.33 1.5 11.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.947 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . 0.427 HG23 ' H ' ' A' ' 587' ' ' VAL . 3.2 t -60.63 -14.58 9.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.318 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -135.32 -20.04 0.74 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.666 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.589 HG22 ' HB3' ' A' ' 560' ' ' PRO . 23.1 t -56.71 148.42 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.676 0.274 . . . . 0.0 110.984 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 19.6 p -130.59 -22.49 2.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.822 -179.565 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.64 179.09 40.17 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.041 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . 0.412 ' CD2' ' HA ' ' A' ' 626' ' ' ALA . 85.9 m-85 -137.12 123.52 20.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.633 0.254 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.616 ' OD1' HD12 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -99.65 128.55 45.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.443 179.467 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.493 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -103.4 131.65 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.854 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 95.8 m-85 -99.43 150.44 22.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.651 -179.722 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -134.05 93.53 3.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.653 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.25 73.79 0.39 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.328 -179.676 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.6 p 47.97 35.93 5.62 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.875 0.369 . . . . 0.0 111.405 -179.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.98 104.59 1.53 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.122 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.616 HD12 ' OD1' ' A' ' 593' ' ' ASP . 2.0 tt -49.54 121.23 4.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.063 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.2 -101.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.199 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 611' ' ' ILE . 4.5 t -90.67 169.95 10.56 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.18 0.514 . . . . 0.0 111.574 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.77 113.94 12.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.362 179.761 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.706 HG11 ' HA ' ' A' ' 609' ' ' ALA . 9.9 m -113.71 -175.17 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.621 -179.172 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.535 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -145.26 7.6 1.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.807 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.38 -120.68 3.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.649 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.49 -14.53 7.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.69 0.281 . . . . 0.0 111.338 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG21 ' A' ' 604' ' ' VAL . 67.6 p -114.09 175.02 5.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.706 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -157.76 126.18 5.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.6 OUTLIER -111.47 133.48 53.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.907 0.384 . . . . 0.0 111.46 -179.66 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.4 mp -114.82 135.13 55.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -102.8 178.5 4.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 72.78 -84.75 0.56 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.427 -179.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.494 HD22 HG21 ' A' ' 644' ' ' THR . 5.0 mt 49.58 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 120.9 0.381 . . . . 0.0 111.625 179.348 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . 0.452 ' HB3' ' OH ' ' A' ' 620' ' ' TYR . . . -168.31 111.27 0.59 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.83 179.938 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -60.4 168.76 1.95 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.493 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.73 28.5 17.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.284 179.821 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.44 148.21 40.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.335 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.49 135.0 33.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.452 179.547 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . 0.452 ' OH ' ' HB3' ' A' ' 615' ' ' ALA . 57.6 m-85 -126.54 146.68 50.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.24 0.543 . . . . 0.0 111.981 -179.474 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.15 103.28 6.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -99.47 165.07 11.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.359 0.6 . . . . 0.0 112.031 -178.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.6 p -151.96 162.9 40.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 179.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.706 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -125.92 153.6 34.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.953 0.406 . . . . 0.0 111.548 -179.8 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.532 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.7 mmtt -140.36 124.63 17.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.047 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 592' ' ' TYR . . . -82.8 100.62 10.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.559 179.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.72 155.08 17.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.012 0.434 . . . . 0.0 111.163 -179.547 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.67 -156.7 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.211 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -49.56 -78.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.647 0.261 . . . . 0.0 111.263 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -161.06 48.35 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.517 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -169.62 9.25 0.05 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.755 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -152.43 131.41 12.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.262 0.531 . . . . 0.0 111.254 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.43 124.47 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.735 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 93.0 p -67.81 -164.55 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.935 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.683 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.44 169.72 10.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.994 179.781 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.4 137.7 32.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.888 179.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.7 p -73.56 -167.53 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.08 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -70.89 166.95 20.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.96 131.97 40.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.329 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.21 110.76 33.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.218 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 620' ' ' TYR . 0.3 OUTLIER -88.73 118.5 28.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.85 -179.937 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.19 127.46 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -90.03 106.48 18.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . 0.494 HG21 HD22 ' A' ' 614' ' ' LEU . 29.8 p . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.219 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 559' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.662 0.268 . . . . 0.0 111.14 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 560' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 559' ' ' ALA . 8.6 Cg_endo -86.73 -172.31 0.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.212 2.608 . . . . 0.0 112.271 -179.954 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.74 134.02 36.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.189 179.967 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 562' ' ' ALA . . . . . 0.649 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -71.17 132.45 86.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 563' ' ' PRO . . . . . 0.515 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.9 Cg_exo -47.61 162.75 0.22 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.666 2.244 . . . . 0.0 112.214 179.64 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.7 t -156.11 161.86 40.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.37 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.43 HD22 ' HA ' ' A' ' 565' ' ' ASN . 3.2 m120 58.66 49.3 10.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.472 179.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.807 HD11 ' HG ' ' A' ' 578' ' ' LEU . 21.7 tp -75.19 158.27 33.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.376 179.479 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 567' ' ' ALA . . . . . 0.555 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.52 178.05 9.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.924 0.393 . . . . 0.0 111.448 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.12 129.51 48.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.22 179.442 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.7 p -103.34 -88.88 0.4 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.631 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.21 100.84 13.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.776 0.322 . . . . 0.0 111.33 -179.583 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 571' ' ' GLN . . . . . 0.652 ' HB2' HG13 ' A' ' 576' ' ' ILE . 4.0 tm0? -121.94 129.11 52.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 5.4 p -115.04 -161.52 0.78 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.766 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 47.5 p -91.55 11.89 22.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.745 0.307 . . . . 0.0 111.425 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 52.2 p -145.05 -43.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.14 172.46 6.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.583 179.817 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.652 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.8 tt -160.27 139.59 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.379 . . . . 0.0 111.3 179.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 15.1 m -108.13 131.26 54.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.807 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -114.24 157.04 23.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.652 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 p -152.28 137.12 17.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.488 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 580' ' ' TRP . . . . . 0.536 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -156.8 169.71 24.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.961 0.41 . . . . 0.0 111.371 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.9 m -81.18 135.69 35.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.136 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.02 172.45 2.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 67.8 p -83.44 9.62 10.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.38 24.68 5.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.231 179.943 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 585' ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' ' 589' ' ' VAL . 5.6 t70 -142.75 45.79 1.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -62.6 -5.55 2.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.261 -179.836 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 5.6 p -76.02 4.19 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.14 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -150.41 -19.8 0.07 OUTLIER Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.881 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 589' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 585' ' ' ASP . 6.0 t -78.93 136.7 23.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 41.4 p -106.84 -7.49 17.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.243 -179.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 591' ' ' GLY . . . . . 0.666 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 167.15 -179.86 40.56 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.67 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.01 128.87 39.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 593' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.7 OUTLIER -103.25 116.76 33.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.809 179.934 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 594' ' ' VAL . . . . . 0.419 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -101.99 136.7 32.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 595' ' ' TYR . . . . . 0.408 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 47.7 m-85 -99.4 168.48 9.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.135 -179.657 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -133.05 84.75 2.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.151 179.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 597' ' ' GLY . . . . . 0.471 ' O ' HG23 ' A' ' 598' ' ' THR . . . 89.56 -59.86 3.67 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.093 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -161.84 -16.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 179.861 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -110.35 136.75 49.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 600' ' ' LEU . . . . . 0.464 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.3 tm? -55.45 125.44 20.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.826 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -95.82 -104.87 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.372 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.0 t -90.54 165.39 13.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.271 0.558 . . . . 0.0 111.936 -179.397 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 57.8 m -129.92 128.36 42.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.003 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 604' ' ' VAL . . . . . 0.722 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.7 m -127.8 -177.93 2.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.839 0.352 . . . . 0.0 111.713 -179.364 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 605' ' ' THR . . . . . 0.666 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 72.1 p -137.87 2.04 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.878 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -117.09 -123.11 3.38 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.424 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 2.0 p -130.6 8.78 4.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.681 0.277 . . . . 0.0 111.165 179.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 608' ' ' THR . . . . . 0.556 ' O ' HG11 ' A' ' 604' ' ' VAL . 40.6 p -130.19 126.18 36.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.266 -179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 609' ' ' ALA . . . . . 0.722 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -114.51 126.1 54.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.247 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 610' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.6 m -111.8 123.67 50.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 611' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -106.56 138.68 30.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.086 -179.982 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.02 163.46 15.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.823 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 67.97 68.43 1.65 Allowed Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.436 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 614' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.0 OUTLIER -123.05 152.5 40.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -97.53 155.07 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.996 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.52 161.89 15.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 55.54 38.91 30.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.008 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.13 141.45 36.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.114 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 89.9 p -87.7 131.26 34.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.721 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.366 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -106.42 118.56 36.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.29 179.249 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -111.34 165.11 12.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.21 0.529 . . . . 0.0 112.004 -179.151 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.91 136.53 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.888 179.514 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 624' ' ' VAL . . . . . 0.517 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.58 151.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 111.755 -179.297 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.7 mttt -139.81 157.65 45.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.704 -179.725 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -109.22 145.2 36.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.201 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 131.36 26.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.764 179.845 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.46 169.81 8.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.981 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.57 37.01 0.85 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.022 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -134.98 18.51 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.967 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 68.34 32.21 75.4 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.588 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 632' ' ' ASN . . . . . 0.58 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 47.5 m-20 -127.57 125.12 39.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.713 0.292 . . . . 0.0 110.915 -179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -119.77 134.93 61.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.885 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 60.2 p -71.56 -170.51 0.54 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.121 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 635' ' ' ALA . . . . . 0.649 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.7 173.72 8.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.596 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 636' ' ' ALA . . . . . 0.488 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.64 134.43 34.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.971 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.3 t -73.06 -172.21 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.15 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 149.38 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -84.24 128.0 34.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 12.2 p -103.23 135.87 38.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -106.99 120.1 41.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.93 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.631 HG21 ' HG3' ' A' ' 571' ' ' GLN . 0.7 OUTLIER -122.92 127.27 74.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.95 179.957 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -96.68 103.52 15.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.184 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.892 0.377 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.26 -61.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.995 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -58.02 142.67 79.46 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.214 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 589' ' ' VAL . 60.7 Cg_endo -72.49 -177.55 2.82 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.538 2.159 . . . . 0.0 112.436 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 69.5 p -91.98 155.78 17.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.105 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.735 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -83.08 127.03 70.86 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.447 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.3 Cg_exo -48.34 138.42 23.55 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.542 2.161 . . . . 0.0 111.683 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 52.5 p -128.28 162.47 26.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.524 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 59.38 54.38 4.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.598 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' ' 578' ' ' LEU . 65.5 tp -69.68 160.78 30.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.417 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.88 176.05 11.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.996 0.426 . . . . 0.0 111.581 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 70.8 p -136.52 122.81 20.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.461 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 7.0 p -99.42 -88.04 0.35 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.19 131.5 34.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.075 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.463 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -150.49 113.65 4.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.825 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.8 p -95.84 -153.57 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.99 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.2 p -97.62 22.41 9.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.9 p -166.15 -46.51 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.502 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.34 133.59 50.8 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.213 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 21.5 tt -124.33 153.17 30.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.043 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.439 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.7 m -122.95 121.68 36.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.793 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -105.72 149.47 26.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.452 -179.307 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . 0.461 ' O ' HD12 ' A' ' 566' ' ' LEU . 0.3 OUTLIER -137.83 143.83 41.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.112 179.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.571 ' CE2' HG11 ' A' ' 624' ' ' VAL . 47.6 p90 -158.55 169.98 23.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.924 0.392 . . . . 0.0 111.483 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.93 128.88 33.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.26 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.99 155.09 32.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.05 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 16.4 m -65.07 142.34 58.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.91 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 6.8 m -64.44 -17.49 63.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.047 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -112.75 143.57 43.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.957 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -152.33 42.55 0.66 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.65 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -86.45 -17.47 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.186 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -152.32 -4.0 0.16 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.551 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 560' ' ' PRO . 12.1 t -64.57 149.44 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.755 0.312 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 39.7 p -124.3 -51.5 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.515 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -153.86 -171.91 21.4 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.904 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -121.52 175.7 6.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.855 0.36 . . . . 0.0 110.975 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.49 ' HB3' HD21 ' A' ' 600' ' ' LEU . 3.6 m-20 -140.21 131.92 27.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.677 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.585 ' HB ' HG22 ' A' ' 602' ' ' THR . 43.1 t -99.9 126.23 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.205 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.429 ' HB2' ' OG1' ' A' ' 623' ' ' THR . 41.3 m-85 -99.97 129.47 46.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.921 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -106.55 84.77 2.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.542 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.91 -86.73 0.95 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.341 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.4 p -143.63 11.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.912 0.387 . . . . 0.0 111.054 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -137.0 151.1 48.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.09 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -60.32 136.02 57.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.878 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.417 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -113.06 -101.82 0.41 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.497 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.585 HG22 ' HB ' ' A' ' 594' ' ' VAL . 12.2 t -88.85 176.93 6.84 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.789 0.328 . . . . 0.0 111.425 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -140.58 140.03 35.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.931 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.805 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.9 m -140.39 177.48 4.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.496 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.515 HG22 ' HA3' ' A' ' 591' ' ' GLY . 1.4 p -144.57 3.26 1.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.018 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.63 -132.02 6.1 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.57 4.71 13.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.689 0.28 . . . . 0.0 111.546 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.411 ' O ' HG11 ' A' ' 604' ' ' VAL . 36.8 p -129.89 -178.98 4.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.805 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -153.78 147.8 25.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.996 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.3 m -127.76 122.43 32.79 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.18 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.506 HD11 HG11 ' A' ' 594' ' ' VAL . 3.5 mt -121.68 118.11 54.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.976 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -102.84 175.24 5.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.866 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.58 70.76 0.99 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.498 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.513 HD12 ' O ' ' A' ' 574' ' ' SER . 8.5 mt -136.93 122.46 19.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.762 0.315 . . . . 0.0 111.087 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -73.37 143.92 46.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.988 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.29 161.4 29.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.384 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.73 44.31 26.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.283 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.1 m -140.12 152.43 46.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.321 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.2 t -89.24 134.03 34.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.68 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -137.78 122.82 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.257 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 64.0 p -103.1 124.22 48.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.569 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -119.21 162.38 18.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.104 0.478 . . . . 0.0 111.732 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.448 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 0.8 OUTLIER -155.35 179.49 9.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.258 179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.571 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -138.54 147.26 25.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.004 0.43 . . . . 0.0 111.596 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.498 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 3.2 mmtp -141.02 120.21 12.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.38 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -80.13 138.45 36.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.634 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.455 ' HG2' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -124.77 161.93 25.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.881 0.372 . . . . 0.0 111.312 -179.725 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER -123.7 155.31 38.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.661 179.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.34 51.66 2.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.189 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.13 3.22 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.172 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 92.28 42.87 4.49 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.55 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.45 ' HB2' ' OD1' ' A' ' 628' ' ' ASP . 5.4 m120 -134.28 119.47 18.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.788 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.0 p -119.37 148.3 22.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.968 0.413 . . . . 0.0 111.34 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 13.3 p -90.25 -165.94 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.772 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.735 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.29 176.18 6.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.714 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.498 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -89.96 146.76 24.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.044 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 6.6 p -81.15 -174.02 4.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.884 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.17 146.64 54.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.555 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 123.17 27.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.9 m -100.79 106.88 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.98 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.55 95.03 8.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.955 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -106.38 136.36 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.081 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.33 114.54 28.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.79 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.201 179.828 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.91 0.386 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.69 69.43 10.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -64.64 152.57 89.54 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.14 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.76 -159.86 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.668 2.245 . . . . 0.0 112.467 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.28 138.94 50.41 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.104 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.98 132.3 86.73 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.23 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.452 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.2 Cg_exo -45.75 155.91 0.48 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.77 2.313 . . . . 0.0 112.116 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 70.2 p -136.52 149.96 48.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.997 0.427 . . . . 0.0 111.742 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 59.36 65.01 1.24 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.004 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' A' ' 578' ' ' LEU . 1.1 tp -88.48 152.64 21.75 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.646 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -178.77 6.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.952 0.406 . . . . 0.0 111.341 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.36 127.38 39.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.309 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.82 -86.16 0.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.326 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.46 97.94 10.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.534 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -117.54 109.83 17.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 53.6 p -90.32 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 34.4 p -89.76 5.52 45.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.412 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.404 ' O ' HD12 ' A' ' 614' ' ' LEU . 20.2 p -140.35 -48.1 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -106.91 165.05 11.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.74 179.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 571' ' ' GLN . 20.3 tt -150.55 146.23 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.887 0.375 . . . . 0.0 111.359 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 85.0 m -109.17 123.65 49.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.808 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.675 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -111.43 131.24 55.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.212 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.7 t -127.05 137.55 53.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.382 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.457 ' CE2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -154.52 169.74 23.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.143 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.1 m -88.01 129.43 35.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.994 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.74 165.09 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.05 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.9 166.57 13.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.033 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.42 -1.4 53.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.836 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -117.95 64.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.915 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.418 ' O ' ' HB ' ' A' ' 587' ' ' VAL . 34.4 t30 -70.9 -153.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.611 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.418 ' HB ' ' O ' ' A' ' 586' ' ' ASN . 47.3 t 74.98 -37.74 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -108.98 -28.09 4.59 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.854 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.416 HG22 ' OD1' ' A' ' 628' ' ' ASP . 21.8 t -68.87 124.26 24.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.607 0.241 . . . . 0.0 110.585 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 18.4 p -123.38 1.15 8.99 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.755 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.18 168.72 40.67 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.161 -1.018 . . . . 0.0 113.193 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 76.1 m-85 -131.08 162.21 30.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.787 0.327 . . . . 0.0 110.602 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.48 ' OD1' HG23 ' A' ' 603' ' ' THR . 48.2 m-20 -126.83 135.44 51.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.868 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.406 HG11 HD11 ' A' ' 611' ' ' ILE . 47.2 t -100.15 129.07 51.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.25 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.431 ' CE2' ' HG3' ' A' ' 625' ' ' LYS . 33.7 m-85 -107.29 129.63 54.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.723 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -123.91 94.23 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.846 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 60.11 72.05 0.68 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.507 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 8.2 p 46.12 34.48 2.11 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.907 0.384 . . . . 0.0 111.356 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.51 107.9 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.759 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.413 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 3.9 tt -52.36 122.83 9.46 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.078 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -91.81 -95.27 0.13 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.247 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 7.6 t -90.73 177.01 6.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.104 0.478 . . . . 0.0 111.79 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . 0.48 HG23 ' OD1' ' A' ' 593' ' ' ASP . 7.5 m -140.61 134.17 30.1 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.545 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.778 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.4 m -136.67 -173.45 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.956 0.408 . . . . 0.0 111.589 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.755 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.6 p -131.81 -25.32 2.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.999 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -92.98 -151.19 27.64 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.484 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 17.7 p -100.41 12.94 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.843 0.354 . . . . 0.0 111.209 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -128.91 155.43 45.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.988 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.778 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.79 155.18 43.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.67 113.99 11.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.525 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -99.78 113.84 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.671 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 13.3 p -101.94 132.26 47.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.913 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.48 1.34 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.491 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 574' ' ' SER . 6.7 mt -137.0 114.35 10.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.768 0.318 . . . . 0.0 110.693 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -67.33 128.49 36.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -64.1 175.14 1.32 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.271 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 25.7 t70 57.09 30.39 18.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.07 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.4 m -140.18 144.74 36.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.45 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . 0.41 ' HA ' ' HB3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -87.87 134.45 33.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.396 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -127.8 139.32 52.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 111.443 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.1 p -117.96 117.9 30.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.11 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.504 ' CE2' HD13 ' A' ' 576' ' ' ILE . 68.2 m-85 -106.68 171.31 7.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.328 0.585 . . . . 0.0 112.164 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.91 173.67 8.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.102 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.552 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -139.68 150.14 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.981 0.419 . . . . 0.0 111.448 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.455 ' HD3' ' O ' ' A' ' 634' ' ' SER . 7.6 mttt -140.54 123.46 16.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.203 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.03 134.85 35.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.308 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -131.63 149.9 52.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.831 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.416 ' OD1' HG22 ' A' ' 589' ' ' VAL . 1.8 m-20 -111.73 -179.6 3.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.12 43.07 1.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.041 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.52 5.27 0.61 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.208 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 86.95 9.27 74.36 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.462 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.564 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.7 m-80 -93.43 116.95 29.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.73 0.3 . . . . 0.0 111.003 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.9 p -125.06 135.38 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.103 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.56 -160.34 0.15 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.993 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -90.48 -177.08 4.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.045 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -89.93 136.77 32.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.082 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.552 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -72.15 -174.27 1.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.778 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.31 142.64 42.63 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.848 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -88.13 126.19 34.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.097 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.443 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 10.2 p -101.02 124.86 54.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.941 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 3.4 p -95.96 89.85 5.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.867 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.56 132.27 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.863 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 619' ' ' SER . 0.4 OUTLIER -112.61 133.66 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 111.126 -179.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.088 179.901 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 53.9 m80 . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.75 0.309 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.27 -13.4 16.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.007 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -68.37 146.93 98.15 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.198 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.425 ' HB2' ' H ' ' A' ' 561' ' ' THR . 83.7 Cg_endo -79.11 -139.23 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.721 2.281 . . . . 0.0 112.456 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.487 HG21 ' OG1' ' A' ' 584' ' ' THR . 0.2 OUTLIER -114.22 134.78 54.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.864 0.364 . . . . 0.0 111.048 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.678 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -78.46 130.11 72.47 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.455 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 52.0 Cg_exo -54.23 171.57 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.68 2.253 . . . . 0.0 112.042 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.8 t -163.6 164.25 24.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.284 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 58.28 34.62 24.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.3 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.804 HD11 ' HG ' ' A' ' 578' ' ' LEU . 35.8 tp -60.92 158.83 12.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.467 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.63 -177.54 5.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.263 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.3 t -144.89 126.97 15.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.066 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 17.8 p -99.78 -81.02 0.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.545 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -83.3 104.28 13.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.584 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.17 89.85 3.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.459 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 79.5 p -80.96 -158.8 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 63.1 p -94.57 22.86 5.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.61 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.444 ' O ' HD12 ' A' ' 614' ' ' LEU . 2.9 p -168.74 -44.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.706 0.288 . . . . 0.0 111.458 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.25 138.78 41.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.67 HD11 HG11 ' A' ' 642' ' ' VAL . 9.5 tt -130.26 148.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.192 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 4.8 m -116.29 109.8 17.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.804 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -100.28 134.59 42.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.899 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . 0.441 ' O ' HD12 ' A' ' 566' ' ' LEU . 34.8 t -130.82 139.97 50.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.667 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.617 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -151.84 170.07 20.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.976 0.417 . . . . 0.0 111.255 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.5 m -79.96 135.35 36.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.057 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.51 173.75 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 p -76.56 155.6 33.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.852 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . 0.487 ' OG1' HG21 ' A' ' 561' ' ' THR . 71.3 p -91.45 18.21 7.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -126.46 -69.34 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 33.2 t-20 55.11 30.81 15.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.031 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 4.2 p -89.52 -12.09 9.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.021 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -156.63 -4.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.428 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 14.8 t -62.58 133.2 28.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.7 0.286 . . . . 0.0 111.179 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.448 HG23 ' HE3' ' A' ' 627' ' ' LYS . 1.3 t -112.47 -24.05 9.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.175 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.548 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -170.96 -177.85 41.13 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.665 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -126.66 133.66 50.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.812 0.339 . . . . 0.0 110.833 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.27 117.43 34.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.502 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.38 132.66 44.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.902 0.382 . . . . 0.0 111.067 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 93.1 m-85 -99.43 170.38 8.66 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.036 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -140.23 85.6 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.319 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 89.18 -67.38 2.89 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.984 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.1 p -155.5 -9.04 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.824 0.345 . . . . 0.0 110.998 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.043 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.418 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -59.12 132.96 55.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.351 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -98.65 -105.67 0.2 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.87 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.9 t -90.77 173.18 8.15 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.962 0.411 . . . . 0.0 111.497 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 4.9 m -139.09 126.97 22.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.654 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.846 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.9 m -126.45 -169.1 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.368 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.548 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 7.2 p -137.36 2.01 2.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.208 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -126.3 -147.47 6.85 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.424 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 81.5 p -105.12 25.92 9.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.828 0.347 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.6 OUTLIER -146.5 127.31 14.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.096 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.846 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.93 140.36 51.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.157 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -116.85 115.05 24.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.914 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.9 mt -114.12 110.46 32.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.189 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 574' ' ' SER . 0.5 OUTLIER -112.5 158.52 19.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.769 179.787 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.48 29.59 9.3 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.617 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.444 HD12 ' O ' ' A' ' 574' ' ' SER . 6.0 mt -91.4 -173.91 3.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.764 0.316 . . . . 0.0 110.937 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -123.18 120.31 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.06 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -57.9 159.78 5.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.476 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 56.94 37.39 28.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.165 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.4 m -140.13 146.54 38.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.255 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 28.1 t -89.47 139.34 30.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.638 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -140.15 125.35 18.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 111.254 -179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.44 123.87 46.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.519 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.413 ' HB2' HG23 ' A' ' 640' ' ' VAL . 67.6 m-85 -115.66 169.08 9.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.244 0.545 . . . . 0.0 111.829 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -159.28 159.62 34.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.59 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.759 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -121.12 148.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.132 0.491 . . . . 0.0 111.948 -179.508 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 634' ' ' SER . 8.3 mttt -140.35 157.89 44.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.688 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.68 141.24 44.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.413 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.448 ' HE3' HG23 ' A' ' 590' ' ' THR . 0.0 OUTLIER -131.16 153.71 49.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.784 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -114.51 174.78 5.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.942 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -82.65 56.3 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.85 -42.31 0.05 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.178 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.79 2.95 1.85 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.472 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -86.81 144.89 26.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.761 0.315 . . . . 0.0 110.849 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 9.8 m -136.03 148.89 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.366 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.429 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.6 OUTLIER -87.18 -161.17 0.66 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.788 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.678 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.06 169.46 11.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.844 0.354 . . . . 0.0 111.012 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.97 140.25 30.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.428 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -78.84 -173.5 3.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . 0.457 ' ND2' ' HB3' ' A' ' 566' ' ' LEU . 0.9 OUTLIER -60.28 155.07 18.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.902 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.83 154.08 27.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.096 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 622' ' ' PHE . 2.9 m -136.93 109.12 7.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.108 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.52 111.16 22.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.706 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.67 HG11 HD11 ' A' ' 576' ' ' ILE . 0.9 OUTLIER -112.55 152.41 14.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.989 -179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -113.98 106.5 14.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.928 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.021 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.776 0.322 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 5.7 mmm -100.04 -80.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -74.3 145.18 82.53 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.559 ' HG2' ' HB2' ' A' ' 634' ' ' SER . 74.4 Cg_endo -73.52 -148.09 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.563 2.175 . . . . 0.0 112.335 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.493 HG23 ' HB2' ' A' ' 583' ' ' SER . 0.1 OUTLIER -119.0 128.25 54.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.934 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.13 128.73 91.34 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.246 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 80.3 Cg_exo -45.16 145.67 3.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.698 2.266 . . . . 0.0 112.086 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 32.8 p -127.82 156.16 42.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.37 . . . . 0.0 111.685 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.08 60.75 3.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.71 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.585 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 13.0 tp -79.29 158.29 27.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.585 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.69 175.07 12.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 0.0 111.673 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 578' ' ' LEU . 13.7 p -127.03 128.94 47.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.267 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.5 p -99.57 -84.55 0.41 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.359 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -86.36 148.89 25.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.368 . . . . 0.0 111.167 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.41 136.78 8.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.732 179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.421 ' HB ' ' H ' ' A' ' 573' ' ' THR . 31.9 p -134.22 -155.3 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.12 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.743 HG22 ' HB2' ' A' ' 616' ' ' ALA . 0.0 OUTLIER -95.28 20.73 8.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.301 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 12.9 p -167.06 -41.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.51 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -109.75 155.85 21.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.275 -179.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.453 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 15.0 tt -159.26 134.98 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 111.242 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 55.6 m -104.46 141.7 35.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.962 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 608' ' ' THR . 54.6 mt -123.7 146.06 48.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 51.9 p -133.39 127.16 32.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.733 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.503 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.8 p90 -137.21 169.6 17.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.172 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.7 m -87.12 138.09 31.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.129 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.76 166.5 2.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.222 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.493 ' HB2' HG23 ' A' ' 561' ' ' THR . 34.9 p -73.61 -3.67 29.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.928 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 59.34 16.29 4.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.077 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -148.27 68.18 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.592 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -82.0 25.24 0.58 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.196 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -62.01 -19.27 21.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.985 0.422 . . . . 0.0 110.661 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -149.69 -14.81 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.242 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 17.3 t -66.02 144.29 14.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.778 0.323 . . . . 0.0 111.065 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 75.4 p -123.74 -48.7 1.9 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.281 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.593 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -140.44 -174.68 14.04 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.787 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -133.81 154.84 50.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.683 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -121.73 137.71 54.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.952 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.426 HG11 HD11 ' A' ' 611' ' ' ILE . 56.1 t -104.19 128.42 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.755 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.54 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 40.7 m-85 -102.2 126.84 49.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.305 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 7.7 p-10 -99.02 84.32 3.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.225 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 82.84 -72.53 2.82 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.226 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 17.2 p -147.45 3.41 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.663 0.268 . . . . 0.0 111.265 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -121.75 173.96 7.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.453 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -90.3 119.15 30.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.638 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -92.83 -104.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.364 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 15.1 t -90.64 173.49 8.02 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 111.616 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 3.1 m -139.52 119.76 13.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.619 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 609' ' ' ALA . 12.7 m -122.41 -172.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.506 -179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.593 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 27.7 p -141.6 -10.04 0.93 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.098 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -102.07 -123.8 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.821 -0.705 . . . . 0.0 112.61 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 26.3 p -122.12 -13.12 8.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.713 0.292 . . . . 0.0 111.245 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.439 ' O ' HG11 ' A' ' 604' ' ' VAL . 27.3 p -105.58 172.74 6.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.081 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.74 155.14 36.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.187 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.9 m -129.95 117.17 19.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.209 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 575' ' ' SER . 5.7 mt -115.84 109.82 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.013 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.8 m -107.66 155.37 20.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.839 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 90.65 54.52 2.06 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.538 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.9 mt -118.82 144.16 46.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.88 0.372 . . . . 0.0 110.937 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -94.91 137.91 33.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.028 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . 0.743 ' HB2' HG22 ' A' ' 573' ' ' THR . . . -68.11 162.08 25.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.422 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 55.51 43.3 28.74 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.307 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . 0.443 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 5.6 m -140.65 146.56 38.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.34 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.6 t -91.16 120.38 32.05 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.527 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . 0.443 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 74.8 m-85 -121.63 129.32 52.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.957 0.408 . . . . 0.0 111.524 -179.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 64.0 p -104.33 141.02 37.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.92 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.655 ' H ' HG12 ' A' ' 640' ' ' VAL . 32.1 m-85 -129.31 169.05 15.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.274 0.559 . . . . 0.0 112.09 -179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.85 168.18 16.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.057 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.535 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -137.8 153.45 27.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.065 0.46 . . . . 0.0 111.56 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.54 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 1.4 mttp -140.41 149.95 43.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.92 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -105.18 136.92 43.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.505 ' HB3' HG22 ' A' ' 633' ' ' VAL . 0.3 OUTLIER -127.88 149.77 50.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.116 -179.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.464 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 1.8 m-20 -107.14 167.36 9.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.651 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.25 -8.92 58.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.149 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.628 ' HB3' HD21 ' A' ' 632' ' ' ASN . . . -92.56 -9.99 39.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 97.27 54.28 1.28 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.823 -0.704 . . . . 0.0 112.71 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.628 HD21 ' HB3' ' A' ' 630' ' ' ALA . 0.6 OUTLIER -137.93 131.68 31.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.779 0.323 . . . . 0.0 110.975 179.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 627' ' ' LYS . 24.9 t -126.32 132.79 70.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.253 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.559 ' HB2' ' HG2' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -79.28 -157.48 0.13 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 179.656 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -89.34 177.23 6.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.872 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.471 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -86.26 143.51 27.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.46 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -73.24 -170.13 0.73 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.964 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.35 146.87 42.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.632 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.06 134.33 36.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.219 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.655 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -99.78 154.43 4.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.935 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.03 81.72 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.805 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.04 132.31 45.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.898 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.0 mtpt -105.54 111.92 24.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.069 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.244 179.976 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 25.8 p80 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.827 0.346 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -107.13 -156.37 0.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.865 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -55.36 155.15 10.15 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.148 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.44 ' HG2' ' HB3' ' A' ' 634' ' ' SER . 40.2 Cg_endo -65.95 173.97 6.37 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.481 2.121 . . . . 0.0 112.236 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 1.4 p -84.97 127.43 34.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.049 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.72 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.86 127.28 91.45 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.042 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.418 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 89.3 Cg_exo -46.18 133.61 15.22 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.657 2.238 . . . . 0.0 112.039 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 27.7 p -117.15 153.4 32.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.658 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 58.95 77.35 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.773 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' ' 578' ' ' LEU . 24.6 tp -83.7 162.4 20.73 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.563 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -159.22 167.31 29.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.985 0.422 . . . . 0.0 111.672 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 80.2 p -128.71 136.37 50.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.53 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -112.07 -88.13 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.504 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.96 108.69 19.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.451 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.566 ' H ' HE21 ' A' ' 571' ' ' GLN . 0.0 OUTLIER -119.91 98.9 6.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.832 179.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.5 p -86.63 -152.54 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.859 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.709 ' HB ' ' HB2' ' A' ' 616' ' ' ALA . 30.4 p -101.56 -10.77 19.81 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.687 0.255 . . . . 0.0 111.687 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 76.2 p -125.71 -33.86 2.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -123.44 159.43 29.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.945 0.403 . . . . 0.0 111.171 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.577 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.0 tt -142.07 151.42 18.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 5.5 m -118.82 127.62 53.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.871 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.1 tp -121.39 137.87 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.332 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 37.5 t -128.6 146.76 50.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.282 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.455 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 48.1 p90 -157.79 170.07 23.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.924 0.392 . . . . 0.0 111.323 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.6 m -79.74 125.51 29.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.233 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.34 153.14 35.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.347 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -70.72 169.72 13.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.789 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.22 -19.19 20.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.959 0.409 . . . . 0.0 111.114 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.601 ' O ' HG23 ' A' ' 589' ' ' VAL . 3.0 t0 -89.03 37.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.767 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -58.46 -13.31 5.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.2 3.45 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.059 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -143.65 -24.73 0.16 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.514 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.601 HG23 ' O ' ' A' ' 585' ' ' ASP . 10.2 t -61.24 144.98 13.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 111.066 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 16.6 p -124.69 -9.96 7.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.286 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.624 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.03 172.45 36.54 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.513 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -124.65 134.12 53.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.866 0.365 . . . . 0.0 111.16 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -100.94 135.84 41.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.451 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.556 HG11 HD11 ' A' ' 611' ' ' ILE . 97.8 t -101.75 135.13 39.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.007 0.432 . . . . 0.0 111.6 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 57.0 m-85 -112.6 129.5 56.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.647 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -122.06 107.85 12.68 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.77 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 57.88 59.59 10.55 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.291 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.1 p 52.64 33.24 13.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.949 0.404 . . . . 0.0 111.327 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.81 111.6 2.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.02 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -47.81 153.67 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.623 -179.679 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -134.93 -86.75 0.38 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.307 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.6 t -90.5 171.24 9.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.191 0.52 . . . . 0.0 111.85 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 46.5 m -140.36 123.53 16.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.494 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.772 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.0 m -128.27 -169.74 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.926 0.393 . . . . 0.0 111.549 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.624 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.1 p -142.0 -31.55 0.54 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.964 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -76.26 -125.22 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.435 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 16.7 p -122.84 -13.09 7.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.734 0.302 . . . . 0.0 111.159 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 50.0 p -108.67 155.71 20.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.021 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.772 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.35 145.28 38.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.071 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.4 m -127.01 119.76 27.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.2 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.577 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.6 mp -104.75 139.51 25.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.936 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -117.83 163.74 16.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 80.6 39.27 14.78 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.509 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.0 OUTLIER -96.55 162.76 13.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 110.996 -179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -125.46 127.03 45.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.913 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . 0.709 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -59.31 160.12 6.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.447 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.83 43.66 30.64 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.207 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.7 m -140.42 146.46 38.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.396 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 6.0 t -86.92 137.54 32.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.472 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -140.12 131.14 26.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.015 0.436 . . . . 0.0 112.113 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.485 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -106.31 130.33 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.482 178.647 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -123.17 166.96 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.375 0.607 . . . . 0.0 112.548 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.09 160.48 27.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.899 -1.046 . . . . 0.0 109.822 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.453 HG23 ' HB3' ' A' ' 637' ' ' SER . 0.0 OUTLIER -128.25 150.95 34.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.098 0.475 . . . . 0.0 111.574 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.527 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.9 mmtt -140.18 149.73 43.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.872 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -110.63 150.42 29.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.747 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.5 141.81 39.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.752 0.311 . . . . 0.0 111.208 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -108.04 165.23 11.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.756 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.29 9.98 21.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.043 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -96.19 -0.04 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.075 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 90.22 27.77 19.68 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.489 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -128.1 159.68 34.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.721 0.296 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.53 145.97 26.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HG2' ' A' ' 560' ' ' PRO . 51.4 p -82.71 -174.81 5.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.72 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.28 178.69 6.08 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.995 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.527 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -88.0 142.95 27.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.006 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.453 ' HB3' HG23 ' A' ' 624' ' ' VAL . 2.4 p -77.2 -166.8 0.77 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.216 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.02 140.35 45.37 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.787 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.72 119.52 22.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.814 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 621' ' ' THR . 8.7 p -99.88 138.36 24.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.165 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.9 t -107.13 89.15 2.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.699 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.438 HG21 HD11 ' A' ' 576' ' ' ILE . 3.7 m -110.02 141.15 26.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.595 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.8 ptpp? -95.97 163.17 13.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.653 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 616' ' ' ALA . 4.9 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.224 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 65.7 m80 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.859 0.361 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . 0.402 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 4.0 mtt -123.57 -64.35 1.16 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.815 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -65.53 137.45 96.49 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.06 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.455 ' HB2' ' H ' ' A' ' 561' ' ' THR . 90.4 Cg_endo -76.94 -149.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.593 2.196 . . . . 0.0 112.256 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.522 HG21 HG23 ' A' ' 584' ' ' THR . 0.2 OUTLIER -113.97 114.49 26.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.046 179.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.44 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -60.58 128.89 88.99 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.983 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.24 151.77 4.14 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.492 2.128 . . . . 0.0 111.899 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.55 156.09 45.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.021 0.439 . . . . 0.0 111.432 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 59.09 45.53 14.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.725 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 580' ' ' TRP . 48.8 tp -66.71 156.7 34.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.439 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.11 168.87 21.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.414 ' HA ' HD23 ' A' ' 578' ' ' LEU . 59.9 p -124.04 143.93 50.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.156 179.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 14.9 p -125.05 -86.35 0.63 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.578 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.79 98.89 8.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.845 0.355 . . . . 0.0 111.194 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.429 HE21 ' HB2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -118.28 102.4 8.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.86 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 15.1 p -87.87 -152.02 0.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.842 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 82.3 p -100.83 -22.65 14.78 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.672 0.272 . . . . 0.0 111.627 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.0 p -122.22 -7.63 8.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.318 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.19 165.18 27.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.898 0.38 . . . . 0.0 111.038 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.424 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 18.6 tt -156.32 144.52 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.011 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.9 m -120.74 127.6 52.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.074 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 568' ' ' SER . 45.2 mt -119.75 136.16 54.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.192 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 14.8 t -126.29 139.06 53.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.316 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.55 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -150.62 169.69 20.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.852 0.358 . . . . 0.0 111.378 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 16.6 m -79.93 131.31 35.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.154 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -66.23 178.67 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.022 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.427 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.8 OUTLIER -84.63 169.87 13.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.922 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . 0.522 HG23 HG21 ' A' ' 561' ' ' THR . 1.4 p -99.2 -15.54 18.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.722 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.454 ' O ' HG23 ' A' ' 589' ' ' VAL . 0.8 OUTLIER -118.04 61.28 0.77 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.017 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 8.7 m-80 -73.83 1.53 10.35 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.005 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.75 -12.47 12.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.325 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -133.98 -18.92 0.93 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.594 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 585' ' ' ASP . 5.3 t -72.79 147.51 9.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.851 0.358 . . . . 0.0 111.105 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.5 p -117.91 -49.65 2.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.197 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.562 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -150.1 171.78 30.03 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.783 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -118.61 133.42 55.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.739 0.304 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.769 ' HB3' HD21 ' A' ' 600' ' ' LEU . 0.5 OUTLIER -111.35 120.5 42.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.943 -179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.37 138.36 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.811 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.493 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 95.7 m-85 -99.97 154.88 18.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.556 -179.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.449 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 13.6 t30 -128.2 84.59 2.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.256 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 97.13 -71.06 0.75 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.426 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.26 4.36 0.14 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 111.378 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -128.2 172.09 11.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.769 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.0 OUTLIER -79.97 119.8 23.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.8 179.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.449 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -90.56 -105.47 0.1 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.011 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.4 t -90.5 162.27 15.12 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 111.238 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.7 m -127.69 128.83 46.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.635 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.0 m -134.45 -176.35 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.375 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.562 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 73.1 p -140.88 -15.42 0.9 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.032 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -91.46 -121.29 2.59 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.621 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 7.7 p -127.99 -4.41 5.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.831 0.348 . . . . 0.0 111.317 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.468 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -113.9 168.86 9.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.136 179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.635 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -154.27 119.4 5.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.915 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.5 m -107.33 120.21 41.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.409 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.424 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.3 mp -109.42 131.04 61.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.749 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 87.4 p -111.98 172.09 7.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 62.5 80.58 0.11 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.469 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.1 mt -137.87 179.58 6.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.856 0.36 . . . . 0.0 110.959 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -124.94 155.23 39.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.905 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 161.84 15.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.317 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 6.2 t70 55.68 43.4 28.11 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.059 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.37 139.05 35.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.333 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.2 t -86.05 131.24 34.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.703 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -129.34 137.39 50.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.282 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.13 119.44 39.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.379 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.409 ' HB2' HG23 ' A' ' 640' ' ' VAL . 71.7 m-85 -113.55 159.87 19.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 111.901 -179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.73 137.69 11.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.217 -0.902 . . . . 0.0 109.792 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.55 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -99.94 149.05 6.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.024 0.44 . . . . 0.0 111.569 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.51 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -136.79 152.94 50.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.04 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.45 137.63 50.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.236 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.44 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.437 ' OD1' HG22 ' A' ' 589' ' ' VAL . 4.2 m-20 -108.78 170.08 8.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.891 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.61 11.04 16.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.999 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -105.51 -13.52 15.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 98.88 41.34 3.11 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.547 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.402 ' ND2' ' HB3' ' A' ' 558' ' ' MET . 22.0 m120 -135.93 130.4 33.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.5 t -124.7 131.09 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.935 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.44 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -77.09 175.21 9.84 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.929 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -65.26 168.05 7.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.265 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.51 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -79.53 140.15 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.91 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.438 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.2 t -67.66 -179.49 1.13 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.013 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -65.57 153.75 40.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.667 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.51 142.35 31.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.299 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.409 HG23 ' HB2' ' A' ' 622' ' ' PHE . 3.7 m -129.91 114.33 29.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.74 123.52 34.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -125.34 119.48 55.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.181 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 15.2 mmmt -92.01 101.34 13.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.194 -0.907 . . . . 0.0 111.104 -179.872 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.771 0.32 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 81.7 mtp -83.83 -17.05 42.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.921 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -62.55 154.54 72.87 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.981 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.17 -152.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.533 2.155 . . . . 0.0 112.445 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.746 ' HB ' ' HB3' ' A' ' 583' ' ' SER . 5.7 m -111.53 131.31 55.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.012 0.434 . . . . 0.0 111.396 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.62 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.58 130.68 88.04 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.383 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.556 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -45.69 146.13 3.94 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.74 2.293 . . . . 0.0 111.819 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.3 p -119.95 137.13 54.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.992 0.425 . . . . 0.0 112.005 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 54.79 94.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.035 179.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.829 HD11 ' HG ' ' A' ' 578' ' ' LEU . 54.6 tp -89.8 160.36 16.55 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.524 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -160.75 178.74 9.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.985 0.422 . . . . 0.0 111.684 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.37 149.4 36.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.421 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 5.4 p -124.83 -84.82 0.64 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.602 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.48 112.5 20.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.433 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.57 ' HB2' HG13 ' A' ' 576' ' ' ILE . 3.4 tt0 -134.9 114.02 12.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.904 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 23.8 p -104.07 -165.78 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.82 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -91.17 29.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.17 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 11.3 p -162.33 -39.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.021 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.19 171.77 8.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.958 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.57 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.5 tt -159.48 151.19 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.979 0.419 . . . . 0.0 111.164 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.3 m -119.43 133.69 55.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.793 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.829 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -121.79 131.39 54.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.027 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.83 127.96 46.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.525 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.453 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 45.6 p90 -137.29 170.05 16.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.93 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.5 m -84.79 134.59 34.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.028 0.442 . . . . 0.0 111.344 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -63.55 168.63 4.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.009 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.746 ' HB3' ' HB ' ' A' ' 561' ' ' THR . 1.2 m -79.75 162.52 25.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.795 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.72 -7.15 58.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.793 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.508 ' O ' HG23 ' A' ' 589' ' ' VAL . 41.1 m-20 -125.16 64.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.823 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.06 0.92 16.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.859 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.71 -9.54 13.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.105 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -130.86 -21.22 1.12 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.405 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 585' ' ' ASP . 22.9 t -70.43 141.81 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.854 0.359 . . . . 0.0 111.121 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.1 t -126.14 -11.43 6.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.111 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.602 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -178.03 -177.57 46.88 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.715 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -134.02 157.94 44.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.85 0.357 . . . . 0.0 110.935 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -120.41 129.66 54.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.463 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.563 HG22 HG13 ' A' ' 624' ' ' VAL . 56.8 t -99.61 140.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.231 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.494 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 92.0 m-85 -123.64 147.93 46.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' A' ' 621' ' ' THR . 25.1 t30 -137.95 88.91 2.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 76.29 59.26 3.39 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.093 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 43.4 p 50.46 44.46 26.94 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.891 0.377 . . . . 0.0 111.261 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.04 121.0 4.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.381 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 594' ' ' VAL . 1.0 OUTLIER -54.97 130.73 42.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.872 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -112.93 -98.65 0.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.349 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 14.7 t -90.61 171.6 9.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.117 0.484 . . . . 0.0 111.821 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 2.8 m -137.58 127.8 26.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.46 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.794 HG11 ' HA ' ' A' ' 609' ' ' ALA . 15.5 m -130.59 -178.22 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.906 0.384 . . . . 0.0 111.542 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.602 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 1.4 p -133.21 -24.93 1.81 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.168 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -85.64 -126.25 1.71 Allowed Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.467 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.44 7.93 6.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.827 0.346 . . . . 0.0 111.039 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -129.2 152.83 48.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.971 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.794 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -126.9 155.7 42.61 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.02 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 89.0 m -134.73 109.11 8.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.997 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.45 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.3 mp -110.52 116.12 51.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.002 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.71 -174.44 2.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.862 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.27 47.65 77.99 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.635 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.2 mt -117.73 173.84 6.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.881 0.372 . . . . 0.0 111.08 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -135.76 169.87 16.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -84.62 171.11 12.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.364 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 55.7 42.42 29.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.814 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.22 143.19 42.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.285 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . 0.47 ' HA ' ' HG3' ' A' ' 643' ' ' LYS . 0.1 OUTLIER -98.61 132.21 44.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.218 179.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -126.62 125.9 42.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.019 0.437 . . . . 0.0 111.911 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 596' ' ' ASN . 1.8 p -110.22 107.71 17.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.643 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.494 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 39.1 m-85 -100.15 156.33 17.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.523 0.677 . . . . 0.0 112.729 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -159.22 122.13 3.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.306 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.563 HG13 HG22 ' A' ' 594' ' ' VAL . 0.0 OUTLIER -99.17 157.45 3.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.25 0.547 . . . . 0.0 111.739 -179.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 635' ' ' ALA . 0.2 OUTLIER -139.98 155.06 47.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.341 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 633' ' ' VAL . . . -104.51 132.14 51.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.793 0.33 . . . . 0.0 110.945 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 632' ' ' ASN . 4.3 pttm -120.81 159.83 24.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.96 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 630' ' ' ALA . 0.4 OUTLIER -112.97 177.85 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.796 179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -76.64 -19.8 57.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.648 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.468 ' H ' ' CG ' ' A' ' 628' ' ' ASP . . . -100.62 31.64 3.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.52 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 56.42 81.38 0.07 OUTLIER Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.726 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.461 ' O ' ' HA ' ' A' ' 627' ' ' LYS . 1.9 t-20 -160.38 126.64 4.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 0.0 110.716 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 6.5 m -121.89 143.91 32.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.96 0.41 . . . . 0.0 111.711 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.462 ' O ' ' HE2' ' A' ' 625' ' ' LYS . 0.9 OUTLIER -82.78 -145.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.075 179.138 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.62 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.68 177.19 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 0.0 110.998 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.51 138.15 31.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.945 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.556 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 12.8 p -67.57 -169.94 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.855 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -63.36 177.68 0.63 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.723 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -106.2 121.31 43.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.193 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.448 HG21 ' HG ' ' A' ' 566' ' ' LEU . 2.9 t -112.03 115.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.684 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 11.1 t -102.47 102.45 12.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.966 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.64 114.77 48.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.928 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.47 ' HG3' ' HA ' ' A' ' 619' ' ' SER . 0.0 OUTLIER -96.86 122.07 39.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.123 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.288 -0.863 . . . . 0.0 111.159 179.768 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.734 0.302 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.9 ptm -144.09 -81.78 0.17 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.96 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -63.88 141.22 97.98 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.047 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.74 -179.2 3.17 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.683 2.255 . . . . 0.0 112.459 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -94.05 136.66 34.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.132 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.408 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -64.24 129.4 94.04 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.5 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.469 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.82 140.08 10.14 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.69 2.26 . . . . 0.0 112.201 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 1.6 t -122.96 153.64 39.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.907 0.384 . . . . 0.0 111.727 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.94 62.55 1.64 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.787 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.832 HD11 ' HG ' ' A' ' 578' ' ' LEU . 55.3 tp -82.4 158.93 23.12 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.423 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.28 176.03 11.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.996 0.426 . . . . 0.0 111.786 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 20.6 p -130.24 122.62 28.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.233 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.8 p -99.83 -86.8 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.69 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.02 96.76 10.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.252 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.81 102.45 9.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 80.9 p -94.69 -155.43 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.18 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.436 HG22 ' O ' ' A' ' 644' ' ' THR . 4.9 p -90.16 3.36 53.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.473 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.408 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 3.4 p -152.49 -49.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.66 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.495 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -99.96 122.28 42.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.794 0.33 . . . . 0.0 111.408 -179.536 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.441 HD12 HG21 ' A' ' 642' ' ' VAL . 14.5 tt -115.49 150.22 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 18.6 m -120.27 119.33 32.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.756 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.832 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -105.85 136.41 45.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.938 -179.617 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.8 122.69 31.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.549 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.4 p90 -138.45 169.59 17.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.029 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.8 m -85.27 147.32 26.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.216 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -65.42 168.19 7.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.339 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -2.15 36.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.885 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.45 21.45 11.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.168 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -153.12 75.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.018 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -87.68 33.86 0.71 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.977 0.418 . . . . 0.0 110.829 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -85.56 -1.25 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.986 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -159.99 -25.84 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.615 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 628' ' ' ASP . 13.6 t -59.03 146.81 8.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.902 0.382 . . . . 0.0 111.258 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.7 p -120.05 -40.0 2.76 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.601 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -159.53 177.29 36.11 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.394 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -123.09 120.12 32.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.812 0.339 . . . . 0.0 111.016 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.52 ' OD1' HG22 ' A' ' 603' ' ' THR . 4.7 m-20 -99.81 120.96 40.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.553 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.69 140.36 19.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.21 170.71 8.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.004 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.453 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 10.5 t-20 -140.26 86.35 2.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.608 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 83.95 -68.34 3.55 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.257 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.4 p -151.28 -12.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -118.82 140.79 49.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.922 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -55.24 149.11 13.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.199 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.453 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -114.63 -107.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.011 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 5.0 t -90.73 168.93 11.38 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.155 0.502 . . . . 0.0 111.667 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . 0.52 HG22 ' OD1' ' A' ' 593' ' ' ASP . 0.6 OUTLIER -132.37 121.26 23.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.543 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.849 HG11 ' HA ' ' A' ' 609' ' ' ALA . 31.5 m -125.64 -171.71 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.507 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.601 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.3 p -140.2 -12.41 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.145 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.11 -139.09 10.6 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.451 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 68.3 p -111.93 11.98 20.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 0.0 111.035 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -132.82 154.25 50.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.967 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.849 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.43 136.56 39.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.6 113.18 20.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.869 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.3 mt -107.26 144.09 16.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.377 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.55 -166.13 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.825 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 59.19 -108.56 1.67 Allowed Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.064 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.3 OUTLIER 56.89 104.33 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.958 179.109 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -70.01 111.69 5.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.634 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . 0.434 ' HB2' ' HB ' ' A' ' 573' ' ' THR . . . -56.35 164.9 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.479 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 59.6 27.64 16.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.06 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.4 m -141.07 138.28 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 4.7 p -80.75 146.48 30.99 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.632 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -140.41 147.86 40.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.939 0.4 . . . . 0.0 111.56 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.536 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.49 120.29 39.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.06 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.468 ' CE1' HD13 ' A' ' 611' ' ' ILE . 96.9 m-85 -109.2 163.01 13.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.32 0.581 . . . . 0.0 112.213 -178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.09 142.92 19.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.604 179.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.578 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -107.94 142.5 20.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.076 0.465 . . . . 0.0 111.633 -179.508 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -132.42 143.34 49.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.898 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.448 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -103.87 138.47 40.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.52 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.2 OUTLIER -128.55 137.0 51.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 589' ' ' VAL . 0.0 OUTLIER -101.42 168.03 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.981 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.84 51.84 2.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.107 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -152.53 -25.43 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.21 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 116.58 28.66 2.47 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.302 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -121.9 124.63 44.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 0.0 110.682 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.52 HG12 ' HB3' ' A' ' 627' ' ' LYS . 9.4 m -120.83 135.82 59.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.375 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.448 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 10.2 p -69.85 -167.52 0.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.408 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.26 164.04 14.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -74.86 126.58 31.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.782 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.498 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.92 -177.12 0.23 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.624 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.11 157.67 9.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.536 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -90.35 131.17 36.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.161 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 3.1 m -114.04 109.71 29.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.049 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.6 119.77 27.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.441 HG21 HD12 ' A' ' 576' ' ' ILE . 12.1 m -123.88 160.28 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.222 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -118.68 112.18 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.876 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 573' ' ' THR . 62.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.26 -0.876 . . . . 0.0 111.168 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.3 m80 . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.785 0.326 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 57.9 21.67 7.88 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -70.9 146.69 93.43 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.914 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.56 -159.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.569 2.18 . . . . 0.0 112.276 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 583' ' ' SER . 4.5 p -112.59 123.63 50.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.11 132.22 87.37 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.699 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 78.5 Cg_exo -49.98 176.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.101 2.534 . . . . 0.0 112.413 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 5.1 t -155.66 148.92 24.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 111.605 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 16.4 m-20 56.77 68.01 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.653 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.884 HD11 ' HG ' ' A' ' 578' ' ' LEU . 49.4 tp -76.78 159.8 29.82 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.49 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.76 179.95 8.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.945 0.402 . . . . 0.0 111.567 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 82.3 p -142.67 130.21 21.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.463 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.7 p -100.6 -82.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.404 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . 0.492 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -86.12 97.08 10.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.24 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.25 97.19 7.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.887 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.6 p -84.14 -150.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.956 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 36.4 p -96.12 -45.24 6.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.73 0.3 . . . . 0.0 111.575 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 91.6 p -107.71 -3.68 18.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.625 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -139.69 163.7 31.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 111.135 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.473 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.5 tt -155.06 149.06 12.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.314 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.492 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.2 m -110.7 125.45 53.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.803 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.884 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.6 OUTLIER -108.94 149.26 29.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.245 -179.566 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.5 t -144.64 135.05 24.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.256 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.541 ' CD2' HG11 ' A' ' 624' ' ' VAL . 42.0 p90 -152.67 169.87 21.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.969 0.414 . . . . 0.0 111.36 -179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.6 110.61 16.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.781 179.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -51.18 151.32 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.304 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 561' ' ' THR . 0.0 OUTLIER -54.44 136.26 44.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.904 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 4.1 m -62.6 -23.63 67.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.858 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.04 46.46 1.01 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.485 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -65.04 -9.62 23.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.155 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 27.1 m -75.04 3.02 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.897 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -142.42 -2.9 1.06 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.427 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.452 HG13 ' O ' ' A' ' 627' ' ' LYS . 44.7 t -96.22 146.84 6.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.797 0.332 . . . . 0.0 110.967 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 8.1 t -111.2 -31.53 7.06 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.632 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.456 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -164.44 -179.9 38.84 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.878 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.41 135.52 44.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.435 ' OD1' HD11 ' A' ' 600' ' ' LEU . 0.3 OUTLIER -113.69 121.23 43.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.356 179.358 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.402 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -99.55 140.78 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.947 0.404 . . . . 0.0 111.206 -179.588 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -98.97 166.16 11.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.978 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -140.24 86.94 2.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 71.49 60.79 4.18 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.009 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.7 p 55.37 37.45 28.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.92 0.39 . . . . 0.0 111.487 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.65 112.25 2.14 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.435 HD11 ' OD1' ' A' ' 593' ' ' ASP . 1.1 tm? -45.88 131.17 9.58 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.353 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -113.08 -96.89 0.44 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.353 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.2 t -90.6 168.29 11.91 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.186 0.517 . . . . 0.0 111.985 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 18.2 m -132.5 141.6 48.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.575 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 3.5 m -140.35 -177.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.431 -179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.456 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 36.4 p -140.25 -13.27 1.04 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.932 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -98.1 -124.88 5.09 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.61 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.13 -14.67 8.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.853 0.358 . . . . 0.0 111.3 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -101.24 176.64 5.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.14 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -158.78 123.57 4.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.138 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.6 m -105.42 117.27 33.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.235 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.7 mt -106.8 125.34 62.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.001 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.75 173.35 6.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.02 67.62 1.96 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.551 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 644' ' ' THR . 1.2 mp -130.59 153.5 48.83 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.703 0.287 . . . . 0.0 110.966 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -121.45 141.45 50.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.158 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.93 174.31 7.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.249 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.68 28.72 14.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.016 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.2 m -139.16 141.42 38.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.151 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.99 137.38 32.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.587 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -132.62 133.19 43.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.391 . . . . 0.0 111.409 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -113.92 111.44 21.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.285 179.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -102.11 165.36 11.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.215 0.531 . . . . 0.0 111.913 -179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.495 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.6 OUTLIER -160.22 150.26 18.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.75 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.541 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -110.49 145.71 16.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.174 0.511 . . . . 0.0 111.777 -179.552 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 1.1 mmtp -134.37 127.58 31.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.775 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -81.71 142.91 32.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.166 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.595 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.59 145.15 38.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -107.13 -177.51 3.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -86.23 -9.2 56.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.4 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -87.66 -6.0 58.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.129 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 91.09 23.34 30.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.46 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.4 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 2.4 m120 -108.27 148.09 30.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.686 0.279 . . . . 0.0 110.698 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.595 HG12 ' HB3' ' A' ' 627' ' ' LYS . 16.7 m -137.66 146.34 27.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.907 0.384 . . . . 0.0 111.43 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.85 -166.05 1.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.556 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.43 169.88 16.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.806 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.493 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.09 135.62 36.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.879 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.54 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -68.72 -175.27 0.66 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.426 -179.703 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.81 142.62 57.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.695 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.495 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -81.72 123.11 28.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.151 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 9.6 p -99.66 144.46 12.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.734 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.9 t -118.89 109.74 16.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.87 134.2 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.248 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -96.34 115.93 28.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.723 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . 0.544 HG21 HD23 ' A' ' 614' ' ' LEU . 21.9 p . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.005 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.739 0.304 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 3.6 mtm 59.41 20.53 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.933 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -79.51 152.72 75.82 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.99 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.45 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.428 2.085 . . . . 0.0 112.25 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.439 HG21 ' H ' ' A' ' 584' ' ' THR . 0.1 OUTLIER -103.77 130.41 51.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.968 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -70.27 126.9 92.51 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.456 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 76.6 Cg_exo -47.5 148.15 5.69 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.556 2.171 . . . . 0.0 112.094 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 30.6 p -138.58 161.11 37.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 111.387 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 58.1 51.85 8.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.609 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.906 HD11 ' HG ' ' A' ' 578' ' ' LEU . 11.5 tp -73.89 158.61 34.15 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.583 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.18 -177.64 6.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 111.531 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 86.8 p -138.97 125.72 20.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.368 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.1 p -99.8 -86.14 0.39 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.509 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.19 102.78 15.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.195 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.492 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.7 OUTLIER -121.25 116.86 25.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.957 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.5 p -98.56 -159.15 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.195 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -89.75 2.43 54.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.536 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.47 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.3 p -142.39 -47.99 0.35 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.803 0.335 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 1.0 OUTLIER -100.08 166.37 11.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.82 179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.492 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.3 tt -154.91 142.58 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 7.0 m -109.21 113.55 26.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.78 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.906 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.0 OUTLIER -102.86 134.06 46.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.203 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 t -128.64 133.97 48.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.258 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.54 ' CE2' HG11 ' A' ' 624' ' ' VAL . 42.9 p90 -146.94 169.76 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.171 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -79.98 132.4 36.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.262 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -67.15 159.8 28.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.094 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.2 p -74.78 158.73 32.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.79 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . 0.439 ' H ' HG21 ' A' ' 561' ' ' THR . 0.1 OUTLIER -69.86 -17.87 63.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.265 -179.877 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -103.42 161.73 13.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -160.96 -10.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.957 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -6.34 8.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.746 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.33 -35.44 0.37 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.506 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 589' ' ' VAL . 4.7 t -59.07 148.45 6.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.5 -19.27 2.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.369 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.554 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -177.73 173.42 46.05 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.806 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -127.84 130.4 48.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.683 0.278 . . . . 0.0 110.836 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.84 126.26 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.614 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.443 HG21 HD11 ' A' ' 611' ' ' ILE . 0.2 OUTLIER -100.48 137.19 28.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.01 0.433 . . . . 0.0 111.625 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.753 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 98.0 m-85 -102.36 157.61 16.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.87 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -140.4 100.19 3.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.625 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 58.18 68.56 1.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.202 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.2 p 48.12 33.26 3.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.424 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.47 105.7 1.88 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.768 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.753 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.5 OUTLIER -47.92 137.7 9.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.386 -179.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.28 -98.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.9 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 4.0 t -90.64 168.39 11.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.185 0.517 . . . . 0.0 111.741 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 5.1 m -133.19 134.58 44.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.302 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.829 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.9 m -134.54 -179.75 3.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.496 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.554 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 40.5 p -132.29 -5.94 3.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.31 -131.04 6.9 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.471 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.09 4.69 10.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 111.063 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.469 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -128.63 140.1 51.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.9 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.829 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -119.79 157.77 27.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.164 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.75 102.46 5.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.962 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.462 HD13 ' CE1' ' A' ' 622' ' ' PHE . 4.2 mt -99.64 121.03 49.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.98 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.8 t -110.91 174.75 5.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.45 62.28 4.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.466 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.47 HD12 ' O ' ' A' ' 574' ' ' SER . 7.9 mt -130.74 143.14 50.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.866 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.24 142.92 35.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.043 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -76.99 159.22 30.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.285 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 11.5 t0 55.48 49.68 16.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.065 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 6.3 m -139.96 144.55 37.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . 0.528 ' HA ' ' HG2' ' A' ' 643' ' ' LYS . 13.6 t -85.12 112.77 20.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.518 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.3 m-85 -115.83 134.54 54.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.954 0.406 . . . . 0.0 111.607 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.464 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.3 OUTLIER -111.31 125.34 53.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.235 179.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.462 ' CE1' HD13 ' A' ' 611' ' ' ILE . 73.2 m-85 -118.96 162.09 19.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.27 0.557 . . . . 0.0 111.935 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.03 138.56 10.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.861 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.54 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.78 151.6 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.065 0.46 . . . . 0.0 111.691 -179.576 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.435 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.6 mmtp -136.77 143.19 43.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.945 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -101.7 143.24 31.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.679 ' HB3' HG12 ' A' ' 633' ' ' VAL . 0.0 OUTLIER -139.0 149.71 45.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.708 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.27 174.89 5.65 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.15 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.37 45.48 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.373 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -151.34 -17.47 0.2 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.957 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 105.44 36.5 2.84 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.343 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.516 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 87.5 m-20 -119.15 109.56 16.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.762 0.315 . . . . 0.0 110.827 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 627' ' ' LYS . 25.5 m -109.08 131.25 60.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.296 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.59 -168.63 0.72 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.659 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -72.91 173.22 9.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.834 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.435 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -88.46 136.46 32.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.856 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.413 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.8 t -63.98 -174.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.273 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.53 143.71 48.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.686 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.544 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.68 127.59 32.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.281 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 640' ' ' VAL . 7.4 p -104.39 116.25 47.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.93 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.45 81.39 6.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.557 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 11.0 p -103.78 139.69 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.172 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.528 ' HG2' ' HA ' ' A' ' 619' ' ' SER . 0.6 OUTLIER -111.54 155.53 23.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.654 179.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.246 -179.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.757 0.313 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 21.3 mmt 60.76 -86.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -68.66 156.63 90.47 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.91 -144.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.663 2.242 . . . . 0.0 112.168 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.706 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 0.2 OUTLIER -117.0 121.23 40.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.5 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.42 130.12 94.06 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.142 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.481 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.2 Cg_exo -48.95 170.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.808 2.339 . . . . 0.0 112.341 179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 4.6 t -158.49 159.13 35.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.252 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 55.88 59.68 3.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.492 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.748 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.1 tp -85.58 155.51 21.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.658 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.74 175.52 12.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.322 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 18.8 p -123.72 134.23 53.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.6 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -105.99 -86.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.275 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.66 98.58 11.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.422 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.519 ' NE2' ' HB ' ' A' ' 642' ' ' VAL . 11.1 tt0 -111.36 134.5 52.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 24.1 p -126.18 -162.19 1.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.928 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 35.5 p -94.0 24.25 4.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.244 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 53.2 p -165.79 -47.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.1 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -114.57 126.82 55.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.186 -179.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.493 HG13 ' HB2' ' A' ' 571' ' ' GLN . 18.1 tt -120.44 144.78 28.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.061 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -104.63 133.03 50.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.863 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.748 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -121.78 143.86 49.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.02 0.438 . . . . 0.0 111.386 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -139.4 138.59 36.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.396 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.584 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.4 p90 -153.55 169.67 22.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.036 0.446 . . . . 0.0 111.269 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.49 128.37 33.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.184 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.54 169.64 2.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.706 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 11.3 p -67.9 -13.89 62.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.952 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.17 11.86 4.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.279 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -109.9 -65.05 1.19 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.634 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 41.1 t30 55.85 21.22 4.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.235 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 14.6 p -65.31 -25.25 36.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -162.78 2.11 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.405 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 10.2 t -64.93 146.27 13.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.771 0.32 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 629' ' ' ALA . 20.7 p -115.7 -38.96 3.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.46 176.82 40.97 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.717 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -117.85 149.29 41.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.724 0.297 . . . . 0.0 110.724 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.56 116.28 20.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.876 -179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.98 137.52 27.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.94 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -99.44 168.75 9.79 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.087 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.572 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 6.2 t-20 -135.15 88.07 2.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.541 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 93.84 -64.13 1.8 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.238 -179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -152.96 -39.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -90.27 171.15 9.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.042 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -75.06 133.12 41.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.033 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -99.8 -107.44 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.851 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.91 168.02 12.0 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.156 0.503 . . . . 0.0 111.554 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 16.6 m -131.49 133.5 45.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.542 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.2 m -137.87 -174.07 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.561 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.477 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.5 p -138.88 -15.87 1.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.045 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.68 -146.96 20.85 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.743 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.7 p -104.65 20.27 18.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.889 0.376 . . . . 0.0 111.194 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.44 ' O ' HG11 ' A' ' 604' ' ' VAL . 38.6 p -136.49 160.88 37.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.964 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -139.32 148.3 42.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.0 106.25 7.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 575' ' ' SER . 2.7 mp -99.91 122.86 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.807 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 83.1 p -100.32 172.6 7.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.928 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 75.73 -87.71 0.85 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.373 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.447 ' HB3' ' H ' ' A' ' 615' ' ' ALA . 1.5 mt 47.62 -156.92 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.836 0.351 . . . . 0.0 111.505 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . 0.447 ' H ' ' HB3' ' A' ' 614' ' ' LEU . . . -164.58 134.74 3.96 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.791 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -81.96 166.11 20.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.496 -179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.69 35.92 24.67 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.172 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.33 168.53 19.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.215 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.84 120.72 40.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.192 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -122.9 151.0 42.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.098 0.475 . . . . 0.0 111.993 -179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.8 OUTLIER -124.87 130.2 51.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.756 178.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.449 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 84.2 m-85 -114.63 155.75 25.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.419 0.628 . . . . 0.0 112.385 -178.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 4.7 p -149.14 148.55 29.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.502 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.584 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -116.54 153.87 18.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.983 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 0.5 OUTLIER -140.0 171.64 13.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.664 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.9 125.97 38.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.316 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -116.23 152.09 34.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.998 179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -109.68 176.43 5.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.926 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 590' ' ' THR . . . -90.22 45.95 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.208 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -149.38 -28.44 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.045 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 123.1 6.71 7.48 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.343 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -96.94 119.9 36.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.886 0.374 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 6.6 p -115.9 147.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.91 -159.72 0.4 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.599 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.5 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.14 177.07 6.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.901 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -87.84 150.54 23.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.979 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.474 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -86.1 -171.87 3.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.062 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -64.93 159.77 22.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -100.81 123.76 45.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.22 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.7 p -99.89 123.34 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.931 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.03 103.51 15.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.671 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.519 ' HB ' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -107.52 146.32 13.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.222 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -104.19 108.15 19.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.732 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 25.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.138 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.77 0.319 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 2.7 ptp -104.71 -70.89 0.76 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.937 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -63.35 143.41 97.78 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.156 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.426 ' HD3' ' HB2' ' A' ' 632' ' ' ASN . 70.7 Cg_endo -72.99 -153.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.616 2.211 . . . . 0.0 112.314 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 2.4 m -116.11 136.17 53.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -74.9 128.67 84.77 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.151 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.411 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 77.0 Cg_exo -47.45 154.4 1.64 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.681 2.254 . . . . 0.0 112.211 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.84 153.83 47.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.295 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 57.03 66.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.359 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.828 HD11 ' HG ' ' A' ' 578' ' ' LEU . 36.3 tp -86.93 159.8 18.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.276 179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.479 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.44 172.93 15.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 0.0 111.732 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -127.39 135.03 49.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.176 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.68 -85.86 0.51 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.775 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . 0.474 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -85.08 102.88 13.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.863 0.364 . . . . 0.0 111.482 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.88 130.61 55.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.659 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 63.6 p -124.32 -156.81 0.74 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.297 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.2 p -94.69 22.58 6.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.408 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.502 ' O ' HD12 ' A' ' 614' ' ' LEU . 86.2 p -164.71 -48.76 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.123 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.68 164.53 11.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.935 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.406 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 12.3 tt -158.29 145.6 8.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.329 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.474 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.0 m -107.32 136.11 47.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.497 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.828 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -127.63 125.5 40.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.872 0.367 . . . . 0.0 111.313 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 29.2 t -121.67 137.92 54.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.354 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.565 ' CD2' HG11 ' A' ' 624' ' ' VAL . 46.4 p90 -150.5 169.7 20.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.886 0.374 . . . . 0.0 111.36 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 29.9 m -82.24 139.54 34.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.039 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.52 167.93 2.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.935 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.627 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 90.6 p -69.83 -3.98 18.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 9.9 p 52.52 24.36 3.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.007 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -124.0 -54.45 1.72 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.748 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 45.62 -154.74 0.04 OUTLIER 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.825 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.4 t 54.32 19.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.151 0.501 . . . . 0.0 110.595 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -170.74 -28.79 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.801 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 591' ' ' GLY . 15.5 t -80.01 134.8 26.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.529 0.205 . . . . 0.0 110.629 179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.494 HG21 ' HB2' ' A' ' 629' ' ' ALA . 31.4 p -124.96 23.96 7.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.75 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 152.16 167.86 15.71 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.247 -0.977 . . . . 0.0 113.182 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.27 127.27 37.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.85 0.357 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.656 ' HB3' HD11 ' A' ' 600' ' ' LEU . 2.7 m-20 -105.39 116.96 32.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.338 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.31 137.37 26.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.933 0.397 . . . . 0.0 111.268 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.422 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 87.1 m-85 -99.68 169.4 9.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.269 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -133.96 84.53 2.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.042 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 598' ' ' THR . . . 91.15 -52.66 3.19 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.224 -179.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.7 OUTLIER -158.53 -50.98 0.06 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.736 0.303 . . . . 0.0 111.225 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.85 173.48 12.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.958 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -79.33 149.29 31.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.418 ' N ' ' HG ' ' A' ' 600' ' ' LEU . . . -116.34 -104.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.748 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.417 ' CG2' ' HB1' ' A' ' 609' ' ' ALA . 9.9 t -90.92 162.65 14.67 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 111.151 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 22.8 m -127.33 117.13 21.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.899 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.735 HG11 ' HA ' ' A' ' 609' ' ' ALA . 19.8 m -124.22 -173.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.507 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.75 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 25.1 p -140.75 -11.86 1.0 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.056 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -100.58 -140.84 11.56 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.632 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.93 27.99 9.16 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.786 0.326 . . . . 0.0 111.317 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.522 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.3 OUTLIER -149.93 153.24 36.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.949 179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.735 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -137.49 144.09 42.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.028 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 34.5 m -122.35 110.89 16.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.281 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.406 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.6 mp -105.24 122.02 58.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.957 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 7.7 t -117.68 170.39 8.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.856 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 76.83 52.62 5.74 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.383 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.502 HD12 ' O ' ' A' ' 574' ' ' SER . 6.6 mt -122.27 161.8 22.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.87 0.367 . . . . 0.0 110.926 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.81 158.77 16.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -85.57 164.72 17.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.254 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 37.9 t0 55.91 42.33 28.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.222 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.5 m -140.54 139.24 35.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.407 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.68 136.43 35.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.237 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -135.73 118.66 16.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 111.739 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.97 107.4 18.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.906 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -99.52 160.48 14.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.363 0.602 . . . . 0.0 112.035 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.412 HG22 ' O ' ' A' ' 638' ' ' ASN . 4.5 p -150.89 152.88 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.835 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -113.83 152.87 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 111.482 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.0 mmtt -140.17 148.95 42.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.192 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -107.64 139.18 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.111 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.2 149.68 52.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.989 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 75.5 m-20 -113.73 169.89 8.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.866 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . 0.494 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -81.75 7.81 11.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.151 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -104.15 -11.35 17.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.999 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 100.97 15.04 29.65 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.445 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.426 ' HB2' ' HD3' ' A' ' 560' ' ' PRO . 0.3 OUTLIER -97.18 141.21 30.58 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.848 0.356 . . . . 0.0 110.859 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.3 t -133.78 129.33 54.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.926 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.02 -171.59 2.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.795 179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.41 176.0 10.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.915 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -90.18 134.5 34.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 5.0 t -66.0 -179.46 0.74 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.149 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . 0.539 ' ND2' ' H ' ' A' ' 566' ' ' LEU . 1.9 p30 -59.47 163.2 4.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.704 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -96.37 129.04 43.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.42 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.97 105.64 18.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 73.5 m -84.56 96.17 9.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 1.7 m -113.8 126.56 71.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.984 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -86.63 144.4 27.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.098 179.793 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 13.2 m80 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.83 0.348 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -109.96 76.84 1.01 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.785 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.517 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -77.78 153.8 80.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -72.72 -165.55 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.506 2.137 . . . . 0.0 112.336 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.77 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 22.8 m -94.2 136.87 34.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.172 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.697 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -74.14 129.63 84.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.117 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.541 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 88.0 Cg_exo -46.45 146.98 4.51 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.486 2.124 . . . . 0.0 112.053 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.1 154.21 51.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.968 0.413 . . . . 0.0 111.646 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.72 70.38 0.64 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.466 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.661 HD23 ' HB ' ' A' ' 640' ' ' VAL . 23.9 tp -83.63 159.59 21.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.391 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.529 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.95 169.77 21.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.932 0.396 . . . . 0.0 111.834 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.478 ' HA ' HD23 ' A' ' 578' ' ' LEU . 0.0 OUTLIER -124.69 134.2 52.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.417 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.6 p -109.8 -89.27 0.49 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.533 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.52 99.95 12.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.83 0.347 . . . . 0.0 111.367 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.524 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.8 OUTLIER -122.6 120.85 34.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.684 179.76 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 12.8 p -110.18 -160.25 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.989 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 68.1 p -93.07 27.96 2.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.055 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 13.6 p -165.71 -58.6 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -102.73 129.57 49.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.93 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.524 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.0 tt -120.76 142.89 34.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.387 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 3.1 m -117.21 126.68 53.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.449 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.494 ' O ' ' HA ' ' A' ' 608' ' ' THR . 87.5 mt -119.85 146.44 45.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.009 0.433 . . . . 0.0 111.525 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 144.72 51.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.995 179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CH2' HG11 ' A' ' 624' ' ' VAL . 47.8 p90 -154.61 170.18 22.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.886 0.374 . . . . 0.0 111.282 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.52 131.22 34.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.815 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.06 176.66 0.94 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.405 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.77 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 23.7 p -74.55 147.18 41.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.968 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.23 -10.73 59.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.178 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -91.42 -63.13 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 55.81 29.75 14.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.039 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.8 p -68.55 -24.88 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -163.4 6.53 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 13.9 t -63.9 121.56 13.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 111.112 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.441 HG21 ' HB2' ' A' ' 629' ' ' ALA . 1.3 t -119.48 -29.77 5.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.27 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.669 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -139.78 174.77 22.18 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.748 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.58 162.71 31.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.72 0.295 . . . . 0.0 110.691 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.09 119.11 20.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.858 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.674 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -99.69 146.27 9.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.866 0.365 . . . . 0.0 110.988 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.551 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 34.5 m-85 -120.17 164.66 15.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.822 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -140.32 87.6 2.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.627 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 67.63 71.35 0.95 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.153 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.7 p 47.49 39.6 9.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.928 0.394 . . . . 0.0 111.221 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -160.33 102.05 1.39 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.057 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.0 OUTLIER -49.21 136.3 15.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.154 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -111.91 -98.4 0.42 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.306 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 594' ' ' VAL . 6.5 t -90.6 170.68 9.96 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.305 0.574 . . . . 0.0 111.983 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 1.8 m -136.54 137.26 40.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.864 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.632 HG11 ' HA ' ' A' ' 609' ' ' ALA . 2.3 m -132.03 -176.1 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.929 0.395 . . . . 0.0 111.955 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.669 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.7 p -130.61 -6.92 4.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.734 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.78 -147.38 9.71 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.536 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 1.2 p -100.18 1.99 42.52 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.694 0.283 . . . . 0.0 111.456 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.535 ' O ' HG21 ' A' ' 604' ' ' VAL . 11.6 p -114.32 165.58 12.56 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.902 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.632 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -151.03 134.13 15.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.971 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.2 m -121.84 122.77 40.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.307 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.478 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.8 mp -112.76 128.65 69.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.779 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.0 155.46 20.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.0 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 78.45 58.05 3.21 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.509 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 3.0 mt -115.01 154.5 28.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -103.43 144.77 30.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.021 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -87.39 164.2 16.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.959 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 59.65 35.27 22.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.859 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.87 156.93 47.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.336 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.3 t -95.05 137.53 33.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.455 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -139.41 134.73 32.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 111.269 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 37.4 p -114.21 125.65 54.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.078 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.404 ' CE2' HD13 ' A' ' 576' ' ' ILE . 92.8 m-85 -113.46 155.14 25.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.279 0.562 . . . . 0.0 111.957 -179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.51 122.58 5.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.827 179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.674 HG13 ' HB ' ' A' ' 594' ' ' VAL . 0.1 OUTLIER -99.25 157.55 3.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.139 0.495 . . . . 0.0 112.029 -178.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 5.7 mttt -136.85 163.54 30.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.411 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.431 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -111.08 133.55 53.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 0.0 111.089 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -126.36 143.84 51.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.958 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -107.52 156.26 19.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.822 -179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . 0.441 ' HB2' HG21 ' A' ' 590' ' ' THR . . . -82.51 62.69 6.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.105 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.405 ' HB3' ' OD1' ' A' ' 628' ' ' ASP . . . -157.89 -39.11 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.974 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 134.06 44.15 0.12 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.771 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 63.3 m-80 -141.91 147.95 37.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.728 0.299 . . . . 0.0 110.927 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -137.36 144.99 30.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.209 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 8.2 p -87.4 -164.69 1.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.752 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.697 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.88 177.49 6.68 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.548 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.558 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.75 141.55 31.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 111.228 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.541 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 1.8 p -72.29 -177.39 2.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.922 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.39 144.18 47.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.689 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.94 112.29 17.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.323 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.661 ' HB ' HD23 ' A' ' 566' ' ' LEU . 1.2 t -100.02 137.13 28.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.591 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.8 m -116.53 109.92 17.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.984 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 7.8 p -115.37 149.72 17.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.996 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -114.86 128.99 56.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.036 179.816 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.764 0.316 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . 0.482 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 2.9 mtt -147.31 -98.0 0.09 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.117 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.483 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -68.67 141.41 92.79 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-O 120.684 0.278 . . . . 0.0 111.159 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.448 ' HB3' HG22 ' A' ' 589' ' ' VAL . 85.2 Cg_endo -81.28 -157.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.629 2.219 . . . . 0.0 112.418 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.86 150.29 28.63 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.164 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -83.79 128.06 64.92 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.402 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.6 Cg_exo -48.1 153.05 3.0 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.703 2.269 . . . . 0.0 112.146 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.07 160.19 41.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.464 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 18.0 m-20 59.64 45.36 13.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.248 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.456 HD12 ' H ' ' A' ' 567' ' ' ALA . 63.9 tp -68.07 158.12 33.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.76 0.314 . . . . 0.0 110.68 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.456 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -162.07 -176.74 5.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.321 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.505 ' HA ' HD23 ' A' ' 578' ' ' LEU . 83.8 p -123.37 156.64 35.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.32 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.49 -89.4 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.727 0.299 . . . . 0.0 111.478 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -88.04 101.46 13.8 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.19 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.82 99.75 7.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.966 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 19.6 p -95.2 -155.18 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.812 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 14.4 p -96.99 19.59 12.55 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.51 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.546 ' O ' HD12 ' A' ' 614' ' ' LEU . 92.8 p -165.93 -46.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.792 0.33 . . . . 0.0 111.136 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.78 137.88 39.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.912 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.434 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -133.1 141.25 45.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.955 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.43 131.84 55.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.011 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 76.2 mt -121.89 134.96 54.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.906 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 5.5 t -118.76 140.61 49.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.679 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.529 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.6 p90 -152.67 169.72 22.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.085 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.4 m -84.68 115.23 22.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.845 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -50.92 153.35 1.82 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.199 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.93 142.42 15.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.764 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 23.2 p -59.84 -15.35 20.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.228 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -112.46 153.91 26.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.034 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.693 HD22 HG23 ' A' ' 587' ' ' VAL . 0.3 OUTLIER -153.06 -157.83 0.83 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.548 179.924 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.693 HG23 HD22 ' A' ' 586' ' ' ASN . 28.2 t 71.29 -22.19 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.365 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -124.8 -20.84 2.25 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.088 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.448 HG22 ' HB3' ' A' ' 560' ' ' PRO . 96.4 t -70.13 141.8 16.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.658 0.266 . . . . 0.0 110.693 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.632 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -102.42 -67.07 0.89 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.8 -179.336 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.632 ' H ' HG23 ' A' ' 590' ' ' THR . . . -145.38 -176.36 19.27 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.005 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -121.79 127.35 50.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.887 0.375 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.44 ' OD1' ' HD3' ' A' ' 627' ' ' LYS . 5.5 m-20 -101.65 118.3 36.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.423 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.73 135.18 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.957 0.408 . . . . 0.0 110.909 -179.791 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.728 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.0 m-85 -102.59 151.1 22.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.847 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -127.74 93.14 3.62 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.178 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 50.7 72.93 0.42 Allowed Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.926 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.5 p 50.07 37.41 14.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.075 0.464 . . . . 0.0 110.931 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.9 94.66 1.14 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.728 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.728 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.3 tt -44.92 129.96 7.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.441 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.58 -103.05 0.19 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.129 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.4 ' O ' HG13 ' A' ' 594' ' ' VAL . 12.5 t -90.65 172.51 8.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.139 0.495 . . . . 0.0 111.683 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . 0.428 HG23 ' OD1' ' A' ' 593' ' ' ASP . 63.1 m -138.32 105.29 5.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.268 179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.729 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.8 m -105.98 -167.06 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.576 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.603 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 18.0 p -142.88 -0.55 1.16 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.031 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.88 -143.02 7.75 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.655 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.422 ' HB ' ' O ' ' A' ' 580' ' ' TRP . 4.8 p -104.39 6.92 35.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.086 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -126.22 141.38 51.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.303 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.729 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -127.15 117.81 23.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.961 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.19 118.94 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.235 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.434 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -111.86 129.78 66.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.081 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 6.6 p -117.33 142.49 47.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 97.55 64.2 0.89 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.51 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.546 HD12 ' O ' ' A' ' 574' ' ' SER . 3.5 mt -130.86 158.47 40.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.846 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -110.64 138.73 46.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.154 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.83 172.37 8.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.177 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 28.4 t0 56.32 34.91 24.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.262 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.21 141.7 35.9 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.484 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.92 130.09 35.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.617 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -130.78 142.1 50.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.92 0.391 . . . . 0.0 111.501 -179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 1.3 m -120.4 133.35 55.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.342 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -121.88 156.79 32.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 0.0 112.068 -179.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 3.1 p -152.53 131.6 12.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.587 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.529 HG11 ' CZ2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -98.84 153.43 4.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.303 0.573 . . . . 0.0 111.804 -178.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.637 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 7.2 mttt -140.5 143.39 35.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.492 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -103.76 116.52 32.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.85 0.357 . . . . 0.0 111.741 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.44 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 0.0 OUTLIER -108.52 149.53 28.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.537 179.524 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.44 160.25 14.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.754 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.41 50.39 1.45 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.424 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -155.87 -35.19 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.012 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 132.21 39.74 0.22 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.396 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.483 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 1.5 t-20 -136.16 116.57 13.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.991 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 14.7 p -116.44 146.08 21.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.007 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.25 -167.0 1.7 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.811 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -77.14 -179.29 5.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.097 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.19 144.78 25.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.999 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.407 ' OG ' HG23 ' A' ' 624' ' ' VAL . 2.5 p -75.58 -174.89 2.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.917 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -64.9 150.1 48.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.785 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -83.92 128.19 34.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.204 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -111.78 105.39 18.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.991 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.2 91.44 8.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.973 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -99.61 171.61 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.172 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -143.5 128.8 18.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.839 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.139 -179.925 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.884 0.373 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 66.3 mtt -81.25 4.47 20.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -59.0 152.48 50.18 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.008 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.57 -152.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.485 2.123 . . . . 0.0 112.194 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.601 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 17.8 m -113.67 127.75 56.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.119 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.521 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -61.42 131.72 92.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.109 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.445 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 82.9 Cg_exo -45.51 159.61 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.883 2.389 . . . . 0.0 112.141 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 46.4 p -134.49 138.03 44.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.019 0.438 . . . . 0.0 111.997 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.73 84.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.202 178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.871 HD11 ' HG ' ' A' ' 578' ' ' LEU . 10.6 tp -90.63 159.39 16.44 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.615 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.73 164.46 31.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.037 0.446 . . . . 0.0 111.805 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.445 ' HA ' HD12 ' A' ' 578' ' ' LEU . 47.3 p -111.55 138.44 48.07 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.256 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.66 -89.88 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . 0.425 ' H ' ' HB ' ' A' ' 577' ' ' THR . . . -89.71 102.76 15.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 111.461 -179.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.462 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.69 143.49 46.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.69 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.431 ' N ' ' HG2' ' A' ' 571' ' ' GLN . 24.6 p -129.92 -159.04 0.93 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.957 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.401 ' H ' ' HB ' ' A' ' 572' ' ' THR . 42.9 p -89.65 1.2 56.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.658 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.8 p -142.04 -50.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.791 0.329 . . . . 0.0 111.212 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -101.58 167.25 10.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.85 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.462 HG13 ' HB2' ' A' ' 571' ' ' GLN . 15.1 tt -155.92 147.42 12.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.425 ' HB ' ' H ' ' A' ' 570' ' ' ALA . 20.8 m -110.02 142.34 41.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.805 179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.871 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.8 OUTLIER -132.89 133.4 43.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.972 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -127.55 139.95 52.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.507 ' HH2' ' HB2' ' A' ' 609' ' ' ALA . 45.0 p90 -154.39 169.68 23.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.3 m -81.5 138.15 35.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.335 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.39 171.84 8.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.223 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.601 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 0.9 OUTLIER -73.35 179.12 4.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.774 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.07 -11.07 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.323 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -77.79 -63.98 1.26 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.051 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 1.8 m120 56.67 -161.6 0.2 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.774 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t 52.95 25.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.128 0.489 . . . . 0.0 110.655 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.97 -30.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.991 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.402 HG22 ' OD1' ' A' ' 628' ' ' ASP . 33.5 t -66.83 138.88 22.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.709 0.29 . . . . 0.0 110.508 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -107.55 -65.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.629 -179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 605' ' ' THR . . . -136.42 -164.79 10.33 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.31 -0.947 . . . . 0.0 113.251 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.423 ' HB2' ' HZ2' ' A' ' 580' ' ' TRP . 95.3 m-85 -135.25 138.86 43.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.738 0.304 . . . . 0.0 111.009 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.14 119.22 38.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.414 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.2 137.78 25.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -104.13 147.76 27.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.726 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -109.05 84.15 1.87 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.323 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.5 -77.78 1.98 Allowed Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.499 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.7 p -142.56 12.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.995 0.426 . . . . 0.0 111.138 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -132.69 174.51 10.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.382 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.95 133.91 34.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.77 0.319 . . . . 0.0 110.516 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -101.21 -108.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.692 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 3.4 t -91.79 171.83 8.88 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.303 0.573 . . . . 0.0 111.813 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.6 124.66 27.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.913 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.671 HG11 ' HA ' ' A' ' 609' ' ' ALA . 10.6 m -121.67 175.02 5.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.928 0.394 . . . . 0.0 112.027 -178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.504 ' HA ' ' CA ' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -132.56 -14.87 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.942 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -95.94 -108.98 2.42 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.597 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.72 -29.49 1.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.569 0.223 . . . . 0.0 111.489 -179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.537 ' O ' HG11 ' A' ' 604' ' ' VAL . 2.4 p -88.32 -177.04 5.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.188 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.671 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -160.68 133.04 6.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.977 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.2 m -119.01 110.35 17.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.072 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.414 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.8 mp -103.48 124.34 57.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.825 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 70.3 m -109.06 168.09 9.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 79.89 52.21 4.76 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.666 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 17.2 mt -118.13 165.75 13.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.795 0.331 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -127.44 131.93 50.15 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.932 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -68.53 176.32 2.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.285 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 59.43 22.25 10.72 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.977 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.44 151.32 44.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.364 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 67.6 m -92.37 146.1 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.325 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 55.7 m-85 -139.6 128.88 23.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.91 0.385 . . . . 0.0 111.702 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.03 134.99 46.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.835 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -128.65 163.42 25.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.373 0.606 . . . . 0.0 112.159 -178.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.1 p -147.54 164.8 32.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.83 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.471 HG23 ' CB ' ' A' ' 637' ' ' SER . 0.0 OUTLIER -135.01 142.46 40.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 111.548 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.493 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.7 mttt -131.25 162.87 29.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.737 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -112.9 132.46 55.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.179 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 3.8 ptmm? -123.65 154.6 39.13 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.967 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.402 ' OD1' HG22 ' A' ' 589' ' ' VAL . 0.6 OUTLIER -115.45 -179.91 3.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.894 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.95 -3.41 57.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.192 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -100.21 -0.09 39.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.025 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.27 35.25 15.12 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.652 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.468 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 5.5 m-80 -116.32 132.92 56.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.785 0.326 . . . . 0.0 110.919 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 2.8 p -120.2 147.19 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.094 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.41 -152.05 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.579 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.521 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.35 174.15 7.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.967 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.493 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.13 130.74 36.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.124 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.471 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -67.99 -178.71 1.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -61.76 150.48 36.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.749 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -90.07 125.08 35.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.507 ' HB ' HD23 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -102.39 150.63 6.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.774 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.83 125.97 54.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 6.4 p -127.4 134.99 64.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.934 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.1 111.84 24.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.934 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 19.0 m170 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.755 0.312 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.9 mmt 55.23 -160.14 0.18 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -62.26 150.78 83.7 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.555 ' HB3' HG22 ' A' ' 589' ' ' VAL . 57.2 Cg_endo -70.68 -152.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.508 2.138 . . . . 0.0 112.134 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -116.55 125.72 52.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.927 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.503 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.19 124.22 73.54 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.942 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -46.47 144.52 7.11 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.466 2.111 . . . . 0.0 112.105 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 51.2 p -132.66 155.44 48.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.859 0.362 . . . . 0.0 111.401 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 t30 58.76 64.46 1.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.447 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' A' ' 578' ' ' LEU . 2.0 tp -88.3 156.71 19.04 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.233 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.666 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.13 172.38 16.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.961 0.41 . . . . 0.0 111.589 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.464 ' HA ' HD12 ' A' ' 578' ' ' LEU . 40.1 p -118.18 128.96 55.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.354 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 2.9 p -99.87 -87.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.521 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.44 96.66 10.8 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.825 0.345 . . . . 0.0 111.438 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.585 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.9 tt0 -112.26 136.32 51.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.771 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.7 p -130.66 -162.14 1.19 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.096 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.4 p -91.86 6.66 45.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.451 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.449 ' O ' HD12 ' A' ' 614' ' ' LEU . 77.0 p -135.95 -56.47 0.77 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.24 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.573 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 10.9 t -113.91 158.45 21.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.956 0.408 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.585 HD12 ' HG3' ' A' ' 571' ' ' GLN . 15.4 tt -142.0 136.33 29.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 1.7 m -99.72 129.55 45.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.646 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.2 tp -119.08 133.15 55.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.097 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 84.8 p -125.7 146.95 49.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.291 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.424 ' HB3' HD12 ' A' ' 566' ' ' LEU . 49.1 p90 -159.2 170.33 22.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.936 0.398 . . . . 0.0 111.379 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.33 133.18 36.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.349 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -71.0 174.66 5.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.07 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 t -83.2 149.37 26.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.877 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 3.9 p -75.43 -7.7 54.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.157 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.473 ' O ' HG23 ' A' ' 589' ' ' VAL . 72.9 m-20 -125.25 67.83 1.13 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.738 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -77.77 3.91 13.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.96 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.64 -12.22 15.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.047 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.75 -32.14 0.57 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.543 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.555 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.1 t -61.13 150.39 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.733 0.302 . . . . 0.0 110.96 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.11 -50.6 1.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.426 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . . . . . . . . . . . -147.3 175.15 26.81 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.813 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -122.59 157.86 31.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.794 0.33 . . . . 0.0 110.978 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -137.68 120.88 16.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 623' ' ' THR . 0.2 OUTLIER -101.25 137.16 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.955 0.407 . . . . 0.0 110.731 179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 622' ' ' PHE . 59.2 m-85 -104.07 147.85 26.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.75 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -99.69 84.29 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.132 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 88.11 -62.26 3.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.125 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.4 -20.7 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.994 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -96.07 163.63 13.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.915 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -80.05 118.14 21.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.722 0.296 . . . . 0.0 110.465 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -90.09 -106.38 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.939 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.0 t -91.1 167.68 12.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.103 0.477 . . . . 0.0 111.358 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.31 130.02 38.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.214 179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.823 HG11 ' HA ' ' A' ' 609' ' ' ALA . 17.2 m -131.79 -178.8 2.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.581 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . . . . . . . . . 65.6 p -135.67 -17.09 1.73 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -94.83 -139.08 9.8 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.01 16.92 19.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.291 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.0 OUTLIER -133.89 170.38 15.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.053 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.823 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -148.55 140.93 24.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.849 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -125.95 113.13 16.76 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.476 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.573 ' O ' ' HA ' ' A' ' 575' ' ' SER . 3.0 mt -110.39 108.36 25.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.788 179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.8 166.8 10.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.967 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 82.48 32.42 27.94 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.437 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 574' ' ' SER . 10.8 mt -92.83 166.95 12.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.857 0.36 . . . . 0.0 111.097 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -116.36 147.08 41.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.744 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -78.18 162.09 26.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.506 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 58.43 38.02 25.69 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.408 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.48 147.01 38.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.348 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.17 144.04 28.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.55 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -137.86 153.4 49.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 111.767 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.538 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -125.02 139.44 53.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.098 179.169 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.465 ' HA ' ' O ' ' A' ' 595' ' ' TYR . 44.9 m-85 -132.75 152.07 51.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 112.327 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 594' ' ' VAL . 45.4 p -146.57 128.51 15.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.659 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.516 HG22 HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.53 147.47 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -178.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.542 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 1.8 mttt -132.43 169.8 16.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.499 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -128.08 130.88 48.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.867 0.365 . . . . 0.0 111.379 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -121.02 147.15 45.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.723 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.37 171.93 7.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.08 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -87.06 40.5 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.198 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -139.9 -41.44 0.44 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.076 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 142.1 -9.27 2.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.643 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -83.1 137.64 34.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 111.033 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -129.74 148.61 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.931 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.99 -164.11 1.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.503 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.08 178.01 6.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.024 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -85.69 149.37 25.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.414 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.8 OUTLIER -82.61 -175.8 5.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.896 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -62.2 160.84 12.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.762 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.2 131.65 39.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.222 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.538 ' O ' ' HA ' ' A' ' 621' ' ' THR . 13.6 p -115.59 134.05 60.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 8.3 t -104.99 130.24 53.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -117.05 150.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.973 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.64 88.74 2.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 51.4 p . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.121 -179.986 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.692 0.282 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . 0.5 ' HB3' ' H ' ' A' ' 559' ' ' ALA . 0.6 OUTLIER 54.68 -152.33 0.34 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.939 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.5 ' H ' ' HB3' ' A' ' 558' ' ' MET . . . -59.68 147.95 76.51 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.848 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 628' ' ' ASP . 70.0 Cg_endo -73.41 -178.77 3.88 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.442 2.095 . . . . 0.0 112.319 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.61 154.71 36.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.69 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -91.86 129.97 40.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.334 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.47 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 77.3 Cg_exo -50.12 151.4 9.1 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.511 2.141 . . . . 0.0 111.749 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 45.5 p -139.19 156.89 46.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 0.0 111.693 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.54 54.19 5.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.779 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.831 HD11 ' HG ' ' A' ' 578' ' ' LEU . 16.5 tp -82.38 156.27 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.682 0.277 . . . . 0.0 110.302 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.543 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.04 179.66 7.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.998 0.428 . . . . 0.0 111.67 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 93.2 p -126.75 123.17 36.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.178 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.6 -87.27 0.36 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.846 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -79.78 97.9 6.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.7 -179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -113.33 119.48 37.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.528 179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 11.6 p -113.77 -161.02 0.75 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.006 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 30.1 p -91.46 20.55 5.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.549 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 77.0 p -167.68 -46.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.736 0.303 . . . . 0.0 111.405 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -105.77 130.69 53.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.216 -179.682 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.1 tt -121.05 147.34 24.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.214 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 31.8 m -111.65 131.38 55.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.698 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.831 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.5 tp -121.66 130.44 53.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 11.1 t -126.76 136.59 52.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.68 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.61 ' HH2' HG21 ' A' ' 604' ' ' VAL . 40.9 p90 -150.98 170.41 19.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.837 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.8 m -79.39 127.35 31.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.211 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -61.7 133.31 55.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 4.1 m -72.04 151.92 42.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.992 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.83 -177.51 3.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.279 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 49.6 m-20 54.63 53.4 10.69 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.92 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -65.76 -10.33 36.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.882 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.5 m -66.68 -10.22 11.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.258 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -125.28 -34.8 0.65 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.552 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 627' ' ' LYS . 2.8 t -65.7 130.27 30.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 111.048 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.01 -23.06 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.181 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -175.9 178.22 47.44 Favored Glycine 0 C--N 1.33 0.22 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.65 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -126.03 126.31 44.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.826 0.346 . . . . 0.0 111.014 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.75 118.7 37.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.54 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.81 130.62 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.121 0.486 . . . . 0.0 111.212 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.471 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.5 m-85 -99.67 154.51 18.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.677 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -136.47 90.22 2.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.499 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 70.19 59.55 5.34 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.148 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.6 p 53.58 40.49 31.49 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.962 0.41 . . . . 0.0 111.393 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.84 111.44 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.907 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -48.6 124.28 8.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.336 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -100.75 -106.39 0.23 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.081 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.5 t -91.02 167.67 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.139 0.495 . . . . 0.0 111.525 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 6.6 m -131.78 129.02 40.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.376 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.688 HG11 ' HA ' ' A' ' 609' ' ' ALA . 14.9 m -130.32 -170.03 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.528 -179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.606 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.9 p -145.65 -26.69 0.46 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.97 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -79.03 -113.42 0.22 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.913 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 7.4 p -139.14 3.65 2.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.736 0.303 . . . . 0.0 111.241 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.573 ' O ' HG11 ' A' ' 604' ' ' VAL . 41.1 p -129.46 146.34 51.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.155 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.688 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -124.06 136.02 53.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.031 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.34 129.47 54.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.7 mp -125.45 119.53 55.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.065 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.99 131.44 55.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.007 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 115.99 60.1 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.625 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 6.5 mt -129.61 173.89 10.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.724 0.297 . . . . 0.0 110.698 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -132.3 145.01 50.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.74 173.31 4.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.172 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 55.34 38.17 29.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.64 161.43 36.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.399 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 m -119.99 127.46 52.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.591 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -123.89 149.49 45.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.997 0.427 . . . . 0.0 111.215 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 44.5 p -124.3 106.13 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.395 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.415 ' CE1' HD13 ' A' ' 611' ' ' ILE . 94.5 m-85 -100.0 157.75 16.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.212 0.53 . . . . 0.0 111.749 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.5 p -152.38 134.66 15.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.731 179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.724 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -99.37 141.1 17.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.277 0.561 . . . . 0.0 111.975 -179.158 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.596 ' HE3' ' N ' ' A' ' 636' ' ' ALA . 2.7 mmtp -130.03 152.21 49.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.551 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.604 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -110.15 144.26 39.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.856 0.36 . . . . 0.0 111.466 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -122.12 176.71 5.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.543 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.647 ' HB3' ' HD3' ' A' ' 560' ' ' PRO . 0.0 OUTLIER -138.45 172.15 13.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.84 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -83.82 42.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.368 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -150.16 -6.69 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.165 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 93.13 35.52 6.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.444 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -119.17 138.91 52.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 110.799 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 35.5 m -114.65 151.6 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.204 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.604 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 0.7 OUTLIER -90.33 -157.78 0.5 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.394 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.69 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -88.76 156.96 18.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.791 0.329 . . . . 0.0 110.652 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.596 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -80.05 116.01 19.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.821 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.413 ' HB3' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -56.84 173.3 0.21 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.162 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -58.03 147.49 29.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.884 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.45 139.92 36.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.076 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.6 m -116.51 103.57 15.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.968 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 14.5 t -83.6 106.32 15.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.862 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.432 HG11 ' CD1' ' A' ' 576' ' ' ILE . 10.9 p -109.07 145.12 16.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.157 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 644' ' ' THR . 0.2 OUTLIER -120.29 111.49 17.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.722 179.73 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . 0.458 ' O ' ' HE2' ' A' ' 643' ' ' LYS . 69.6 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.259 -0.876 . . . . 0.0 111.18 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 . . . . . 0 N--CA 1.488 1.425 0 CA-C-O 120.717 0.294 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . 0.413 ' H ' ' HG2' ' A' ' 558' ' ' MET . 0.0 OUTLIER -95.4 22.57 6.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.719 179.747 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.469 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -64.37 148.86 95.66 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.018 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.81 -163.97 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.54 2.16 . . . . 0.0 112.343 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 583' ' ' SER . 5.0 m -100.29 124.63 45.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.101 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.434 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -62.97 129.65 93.48 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.462 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.486 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 85.0 Cg_exo -45.78 151.89 1.18 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.911 2.407 . . . . 0.0 112.295 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.2 p -136.17 155.49 50.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.9 0.381 . . . . 0.0 111.534 -179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 59.5 t30 57.23 67.47 0.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.576 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.856 HD11 ' HG ' ' A' ' 578' ' ' LEU . 15.2 tp -86.69 159.31 19.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.0 179.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.561 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.89 167.37 26.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.985 0.421 . . . . 0.0 111.888 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 4.6 p -121.23 146.65 46.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.334 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.1 p -125.98 -86.03 0.62 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.446 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 576' ' ' ILE . . . -82.15 97.93 8.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.194 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.98 95.28 4.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 69.1 p -84.45 -154.52 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.185 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.49 -11.55 39.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.69 -179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.7 p -136.82 -40.18 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.64 162.45 13.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.176 -179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.48 HG22 ' HB ' ' A' ' 611' ' ' ILE . 17.4 tt -156.46 149.32 10.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.862 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.424 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 10.4 m -119.04 140.06 50.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.75 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.856 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -124.06 149.65 45.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.86 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 9.7 t -142.74 131.27 22.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.211 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.502 ' HB3' HD12 ' A' ' 566' ' ' LEU . 43.5 p90 -149.56 169.65 20.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.204 -179.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 2.0 m -79.89 143.61 34.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.961 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -58.44 170.18 0.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.442 ' O ' ' HB ' ' A' ' 561' ' ' THR . 2.2 p -69.87 -5.4 25.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.959 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.53 16.45 5.29 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.92 -179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -152.49 72.11 0.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.675 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.503 ' HB2' ' H ' ' A' ' 587' ' ' VAL . 0.2 OUTLIER -70.24 -128.87 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.721 -179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.503 ' H ' ' HB2' ' A' ' 586' ' ' ASN . 4.2 m 44.1 26.25 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 CA-C-O 121.119 0.485 . . . . 0.0 111.723 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -176.87 -37.62 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.918 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 21.5 t -72.67 144.4 13.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.564 0.221 . . . . 0.0 110.559 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.3 t -132.43 -30.11 1.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.748 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.49 172.41 30.98 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.319 -0.943 . . . . 0.0 113.011 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -130.93 134.87 47.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.691 0.281 . . . . 0.0 110.647 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -99.99 128.45 46.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.796 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.404 ' HB ' HG22 ' A' ' 602' ' ' THR . 61.6 t -99.66 132.51 44.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.979 0.419 . . . . 0.0 111.308 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.447 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 52.2 m-85 -101.31 124.66 47.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.928 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.497 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 47.6 t30 -100.06 84.61 2.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.92 -80.8 0.79 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.277 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 4.5 p -147.18 16.98 1.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.783 0.325 . . . . 0.0 111.072 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -145.35 173.05 12.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.176 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.57 HD22 ' H ' ' A' ' 601' ' ' ALA . 1.4 tm? -71.07 149.93 46.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.825 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.57 ' H ' HD22 ' A' ' 600' ' ' LEU . . . -132.92 -100.94 0.26 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.342 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 594' ' ' VAL . 14.0 t -90.13 172.65 8.66 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.916 0.388 . . . . 0.0 111.428 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 80.1 m -140.34 126.07 19.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.858 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 609' ' ' ALA . 7.0 m -126.36 -177.09 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.528 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.748 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 67.4 p -137.89 -11.34 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -99.27 -126.52 5.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.464 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 4.4 p -122.72 -4.39 8.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.749 0.309 . . . . 0.0 111.059 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.465 ' O ' HG11 ' A' ' 604' ' ' VAL . 17.2 p -111.23 173.59 6.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.024 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.648 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -155.45 127.74 7.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.075 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.476 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.9 m -114.14 112.91 23.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.157 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.9 mp -105.94 131.9 54.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.937 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 15.9 p -120.89 173.73 7.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.106 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 74.8 44.47 24.98 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.727 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 8.3 mt -117.7 132.52 56.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.818 0.342 . . . . 0.0 110.825 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -79.02 143.88 35.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -74.96 167.38 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.133 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.21 35.06 25.72 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.8 m -137.51 146.43 44.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.232 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.83 136.88 32.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -135.76 140.36 44.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 111.615 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.559 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 2.0 p -111.97 135.02 53.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.532 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.635 ' H ' HG12 ' A' ' 640' ' ' VAL . 54.5 m-85 -126.45 161.27 28.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.279 0.562 . . . . 0.0 112.396 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.529 HG23 ' HA ' ' A' ' 639' ' ' ALA . 0.7 OUTLIER -160.26 159.11 31.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.768 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.415 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -124.14 152.61 29.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.047 0.451 . . . . 0.0 111.497 -179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.551 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 3.8 mttt -139.15 139.36 37.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.803 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.533 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -94.96 116.42 28.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.0 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.1 OUTLIER -108.71 148.59 30.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.104 -179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -116.19 169.92 8.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.773 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -78.64 -13.84 59.62 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.159 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -83.8 5.62 24.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.046 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.03 2.86 90.68 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.404 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 34.3 m-20 -95.81 123.47 39.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.761 0.315 . . . . 0.0 110.846 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.5 p -120.91 136.79 56.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.533 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 1.9 p -69.03 -167.51 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.952 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.434 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.3 -178.46 5.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.751 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.551 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.16 146.0 28.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 4.6 p -82.64 -164.13 0.81 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -66.7 146.63 54.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.617 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.529 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -79.69 148.68 31.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.916 0.388 . . . . 0.0 111.163 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.635 HG12 ' H ' ' A' ' 622' ' ' PHE . 0.5 OUTLIER -114.7 158.46 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.767 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 44.7 t -143.94 105.52 4.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.769 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -123.87 140.01 48.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.098 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.09 102.02 9.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.672 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 75.1 p . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.274 -0.869 . . . . 0.0 111.139 -179.851 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.646 0.26 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER 60.72 105.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.116 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 560' ' ' PRO . . . -56.3 159.42 6.24 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.232 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 559' ' ' ALA . 39.3 Cg_endo -65.48 -169.06 0.13 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.603 2.202 . . . . 0.0 112.396 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.95 118.12 28.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.126 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.599 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -60.17 127.29 85.84 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.406 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 88.4 Cg_exo -46.87 156.66 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.701 2.267 . . . . 0.0 112.034 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.52 159.32 40.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.449 -179.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 60.0 49.94 7.15 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.287 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.841 HD11 ' HG ' ' A' ' 578' ' ' LEU . 56.9 tp -74.07 159.67 32.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.424 179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.451 ' H ' HD12 ' A' ' 566' ' ' LEU . . . -161.33 -176.81 5.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.435 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 35.3 p -133.89 130.59 38.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.332 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.5 p -104.09 -85.29 0.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.454 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.81 103.56 14.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.822 0.344 . . . . 0.0 111.301 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.05 116.94 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.809 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 68.6 p -108.68 -161.43 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.081 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.54 16.98 7.99 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.452 ' O ' HD12 ' A' ' 614' ' ' LEU . 1.8 p -161.63 -43.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.186 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.7 167.11 10.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.633 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.5 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.3 tt -160.44 147.31 5.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.907 0.384 . . . . 0.0 111.27 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 9.4 m -116.55 134.41 54.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.642 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.841 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.5 OUTLIER -118.76 133.94 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.082 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -128.32 132.98 48.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.431 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.621 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.8 p90 -148.29 169.74 19.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.175 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 7.2 m -81.32 115.57 20.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.979 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . 0.74 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -60.1 154.24 19.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.329 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 84.0 p -61.28 132.96 55.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.894 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -19.91 61.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.222 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -89.38 53.58 2.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.453 ' C ' ' H ' ' A' ' 588' ' ' GLY . 42.0 p-10 -72.54 -150.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER 71.53 -17.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -132.66 -26.8 0.63 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.88 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.401 HG13 ' O ' ' A' ' 627' ' ' LYS . 83.4 t -66.87 145.25 13.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.725 0.297 . . . . 0.0 110.81 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.4 -67.09 0.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.48 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.417 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -143.61 -173.06 14.85 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.931 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -125.84 130.85 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 110.876 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -110.26 120.75 43.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.662 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.68 136.16 32.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.906 0.384 . . . . 0.0 110.764 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -99.35 174.97 6.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.157 -179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -140.63 84.43 1.95 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.357 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . 0.461 ' O ' HG23 ' A' ' 598' ' ' THR . . . 86.06 -66.22 3.74 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.233 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.461 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -163.11 31.76 0.09 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.859 179.727 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.65 137.06 11.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.068 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 601' ' ' ALA . 1.0 OUTLIER -56.66 136.22 54.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.202 -179.892 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.459 ' N ' HD13 ' A' ' 600' ' ' LEU . . . -109.74 -104.3 0.37 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.969 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.7 t -90.44 163.09 14.79 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.079 0.466 . . . . 0.0 111.344 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 92.5 m -126.95 131.55 51.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.616 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.786 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -135.71 -179.92 3.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.417 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 44.2 p -136.87 -5.79 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -105.45 -124.16 5.32 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.585 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.74 HG22 ' HB2' ' A' ' 582' ' ' ALA . 80.5 p -129.48 9.76 5.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.733 0.302 . . . . 0.0 111.063 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.542 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 23.2 p -136.47 138.84 41.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.194 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.786 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.47 155.86 36.67 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.948 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 3.2 m -129.76 125.3 35.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.16 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.5 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.5 mt -121.68 119.61 59.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 1.5 m -107.42 173.64 6.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.03 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.66 59.09 8.05 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.612 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.452 HD12 ' O ' ' A' ' 574' ' ' SER . 12.4 mt -119.01 114.03 21.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.713 0.292 . . . . 0.0 111.005 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -65.21 133.67 52.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -67.15 173.18 3.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.69 35.32 25.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.049 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 5.3 m -140.36 142.92 35.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.459 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 3.2 t -99.95 111.92 24.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -105.25 127.6 53.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.552 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.622 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.1 OUTLIER -104.44 109.87 21.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.255 179.122 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.405 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 71.5 m-85 -102.19 161.71 13.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.331 0.586 . . . . 0.0 112.222 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.4 p -150.83 148.87 29.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.524 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -110.14 151.64 12.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.052 0.453 . . . . 0.0 111.784 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.0 mttt -139.93 150.18 44.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.006 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.411 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -112.17 121.84 46.07 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.898 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 589' ' ' VAL . 0.0 OUTLIER -115.44 158.42 22.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.25 -179.558 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -119.03 171.12 8.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.723 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.75 60.53 5.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.108 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -158.92 -43.78 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.1 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 138.68 16.37 0.61 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.496 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -111.99 125.11 53.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.813 0.339 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 28.4 m -119.67 142.65 34.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.355 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 31.7 p -77.68 -172.68 2.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.766 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.599 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.01 167.95 20.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.843 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -87.3 128.99 35.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.066 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.444 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.5 t -65.7 179.49 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.61 157.6 26.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.727 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.622 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -89.24 138.5 31.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.16 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.7 m -112.02 108.63 25.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.044 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.08 111.77 17.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.38 129.04 74.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.042 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -101.82 115.79 31.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 35.9 p . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.282 -0.866 . . . . 0.0 111.125 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.4 m80 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.736 0.303 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 54.92 50.97 14.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.787 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -55.85 154.13 14.76 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.324 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.564 ' HB3' HG22 ' A' ' 589' ' ' VAL . 92.0 Cg_endo -78.32 -158.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.6 2.2 . . . . 0.0 112.42 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 5.3 m -114.31 125.32 53.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.995 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.563 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -59.2 122.88 66.79 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.04 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.454 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 71.0 Cg_exo -48.42 159.33 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.539 2.159 . . . . 0.0 112.109 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . 0.488 HG23 ' OG1' ' A' ' 581' ' ' THR . 0.0 OUTLIER -157.6 169.97 23.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.838 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 59.03 40.46 22.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.048 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.771 HD11 ' HG ' ' A' ' 578' ' ' LEU . 66.2 tp -66.79 157.41 32.97 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.725 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.405 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -162.36 -179.38 6.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.7 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 6.4 p -134.9 122.54 22.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.077 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.6 p -100.78 -88.2 0.37 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.745 0.307 . . . . 0.0 111.65 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -84.22 100.36 11.14 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.276 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.617 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.1 OUTLIER -118.48 114.15 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.745 179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 13.2 p -100.77 -156.87 0.57 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.06 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.59 22.45 9.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.363 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 68.0 p -160.02 -49.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -113.28 131.08 56.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.024 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.617 HG13 ' HB2' ' A' ' 571' ' ' GLN . 17.2 tt -118.6 146.1 23.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.087 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 31.6 m -104.5 138.77 40.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.755 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.771 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -126.37 133.94 51.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 13.3 t -128.47 143.06 50.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.523 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.454 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 41.4 p90 -158.33 169.57 24.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.851 0.358 . . . . 0.0 111.169 -179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . 0.488 ' OG1' HG23 ' A' ' 564' ' ' THR . 73.5 p -80.08 114.51 19.04 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.162 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.9 158.76 6.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.149 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.26 147.55 44.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.96 -5.61 49.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 589' ' ' VAL . 96.2 m-20 -126.35 73.27 1.36 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.908 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -85.31 18.87 2.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.3 p -81.14 -15.06 12.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.075 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -129.37 -24.31 1.04 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.608 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.564 HG22 ' HB3' ' A' ' 560' ' ' PRO . 11.8 t -61.67 143.51 14.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.774 0.321 . . . . 0.0 111.207 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 4.7 t -113.48 -15.98 12.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 171.24 -174.54 44.91 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.718 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -131.04 128.85 41.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.924 0.392 . . . . 0.0 111.075 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.754 ' HB3' HD21 ' A' ' 600' ' ' LEU . 4.2 m-20 -111.14 117.8 34.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.428 179.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.552 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.34 139.0 22.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.999 0.428 . . . . 0.0 111.103 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.437 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 63.2 m-85 -99.4 150.29 22.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.231 -179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.405 ' CB ' ' HB2' ' A' ' 601' ' ' ALA . 2.9 t-20 -113.7 84.53 2.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.961 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 95.82 -65.45 1.19 Allowed Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.093 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 1.3 p -154.74 -27.04 0.12 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.755 0.312 . . . . 0.0 111.152 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -100.01 153.07 19.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.988 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.754 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.5 tm? -58.25 131.34 50.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.937 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' A' ' 596' ' ' ASN . . . -101.35 -105.96 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.552 HG23 HG13 ' A' ' 594' ' ' VAL . 3.8 t -90.49 166.68 13.1 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.954 0.407 . . . . 0.0 111.416 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . 0.478 HG23 ' OD1' ' A' ' 593' ' ' ASP . 53.9 m -130.32 124.32 32.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.856 HG11 ' HA ' ' A' ' 609' ' ' ALA . 25.2 m -130.59 -177.68 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.293 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.475 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 50.6 p -142.4 -0.86 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.06 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -111.79 -144.78 9.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.669 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.6 25.1 11.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.752 0.31 . . . . 0.0 111.168 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -147.27 162.58 38.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.856 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.6 149.99 36.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.737 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 5.1 m -132.45 118.01 18.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.22 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.535 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -99.55 136.79 29.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.692 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.84 -172.21 2.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.962 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.21 -103.29 0.77 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.416 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 574' ' ' SER . 1.1 mp 57.86 177.76 0.06 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.027 0.442 . . . . 0.0 111.537 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -169.82 129.22 0.96 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.927 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -55.12 163.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.4 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.54 31.96 21.61 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.234 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 4.1 m -140.2 148.17 41.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.904 0.383 . . . . 0.0 111.432 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.49 140.13 38.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.515 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -134.89 130.18 35.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.315 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 38.3 p -105.39 108.33 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.149 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -99.9 160.2 14.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.272 0.558 . . . . 0.0 112.085 -178.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 1.3 p -154.08 136.07 14.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.814 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.564 HG23 ' HB2' ' A' ' 637' ' ' SER . 0.0 OUTLIER -99.41 151.94 4.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.012 0.434 . . . . 0.0 111.661 -179.346 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 8.4 mmtt -140.42 134.03 30.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.095 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.493 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -92.77 123.41 36.02 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.883 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -117.98 143.86 46.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.041 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.401 ' OD2' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -110.5 160.05 16.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.859 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.31 57.59 4.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.093 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.401 ' HB3' ' OD2' ' A' ' 628' ' ' ASP . . . -157.96 -39.61 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 133.44 32.35 0.39 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.732 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 24.3 m120 -122.53 100.62 7.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.784 0.326 . . . . 0.0 111.061 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.3 t -99.87 119.02 47.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.493 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 24.8 p -67.29 -173.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.979 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.563 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -79.97 166.4 21.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.274 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.468 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.38 142.7 32.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.564 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -74.65 175.55 7.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.044 179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . 0.565 HD21 ' H ' ' A' ' 566' ' ' LEU . 3.7 p30 -60.29 150.94 28.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.592 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.87 137.57 36.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.9 m -116.94 112.31 38.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.913 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 15.2 t -89.15 109.34 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 3.9 m -119.0 144.45 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.13 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -124.84 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.845 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.264 -0.874 . . . . 0.0 111.135 -179.988 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.721 0.296 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.49 40.55 31.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.859 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -60.61 152.95 64.6 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.006 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -68.52 -169.82 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.407 2.071 . . . . 0.0 112.354 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 59.2 m -87.19 120.29 28.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.092 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.691 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -63.15 129.55 93.51 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.107 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -48.01 160.61 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.681 2.254 . . . . 0.0 112.173 179.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.0 t -145.47 163.69 33.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.309 179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 59.68 34.27 22.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.715 179.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.643 HD21 HD22 ' A' ' 578' ' ' LEU . 2.3 tm? -62.95 119.53 9.61 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 179.258 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.41 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -147.61 152.08 37.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.391 . . . . 0.0 111.334 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 5.1 p -93.78 137.76 32.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.72 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 4.2 p -107.49 -87.23 0.49 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.53 108.38 19.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.885 179.65 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.548 ' NE2' HG13 ' A' ' 642' ' ' VAL . 1.0 OUTLIER -123.03 134.55 54.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.141 -179.89 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.453 ' HB ' ' H ' ' A' ' 573' ' ' THR . 25.5 p -108.49 -157.2 0.61 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.865 179.788 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.453 ' H ' ' HB ' ' A' ' 572' ' ' THR . 0.6 OUTLIER -91.38 -12.23 35.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.324 -179.813 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.422 ' O ' HD12 ' A' ' 614' ' ' LEU . 98.0 p -130.62 -44.87 1.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.298 -179.772 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -101.47 170.78 7.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.03 -179.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.476 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.3 tt -160.44 146.26 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.208 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 87.8 m -118.41 114.04 22.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.824 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.643 HD22 HD21 ' A' ' 566' ' ' LEU . 9.3 mt -101.69 137.76 39.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.068 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 24.5 p -125.59 143.84 50.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.437 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.472 ' CE2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -155.32 169.72 23.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.365 . . . . 0.0 111.124 -179.704 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.63 139.26 32.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.36 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -69.63 179.17 2.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.217 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.7 t -80.92 138.61 36.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.873 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 53.3 p -74.07 -1.14 18.81 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.126 -179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.657 ' HB3' HG22 ' A' ' 587' ' ' VAL . 0.8 OUTLIER -105.34 -67.38 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.809 179.868 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 46.7 t30 56.79 24.24 8.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 179.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.657 HG22 ' HB3' ' A' ' 585' ' ' ASP . 2.3 m -89.29 27.06 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.039 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . 167.34 -9.33 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.41 179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 3.6 t -66.46 153.65 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.51 -52.17 0.76 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.419 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.665 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -134.98 179.9 17.18 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.813 -179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -134.75 121.62 20.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.614 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -100.89 126.2 47.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.6 179.757 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.66 142.19 15.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.924 0.393 . . . . 0.0 111.266 -179.495 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.577 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 81.0 m-85 -106.0 151.73 24.25 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.317 -179.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -140.7 97.19 3.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.039 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 56.9 71.59 0.71 Allowed Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.627 179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.2 p 47.62 31.07 1.93 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.813 0.339 . . . . 0.0 111.571 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -157.99 110.3 2.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.775 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.614 HD11 ' HB3' ' A' ' 593' ' ' ASP . 1.6 tt -52.22 133.92 33.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.332 -179.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -97.98 -100.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.868 179.742 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.468 ' O ' HG13 ' A' ' 594' ' ' VAL . 14.4 t -90.84 167.53 12.38 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.201 0.524 . . . . 0.0 111.436 179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.6 m -135.33 117.24 15.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.522 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.681 HG11 ' HA ' ' A' ' 609' ' ' ALA . 18.6 m -117.65 -172.55 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.636 -179.437 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.665 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 6.1 p -143.23 -2.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.957 179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.14 -117.66 4.37 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.479 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -16.77 4.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.696 0.284 . . . . 0.0 111.315 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.487 ' O ' HG11 ' A' ' 604' ' ' VAL . 74.5 p -108.02 167.87 9.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.942 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.681 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -152.32 128.23 10.3 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.046 179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 1.4 m -108.66 119.51 39.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.272 -179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.476 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 3.5 mp -108.48 138.21 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.909 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 68.3 p -121.13 175.59 6.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.898 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 65.09 61.51 5.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.667 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 574' ' ' SER . 9.5 mt -131.2 124.78 31.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.839 0.352 . . . . 0.0 110.816 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -77.5 140.21 39.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -72.98 164.55 26.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.167 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.06 44.59 25.14 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.057 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.6 m -139.98 149.78 43.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -86.17 134.65 33.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.549 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -132.75 152.77 51.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.215 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.49 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.2 OUTLIER -137.75 104.68 5.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.202 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.514 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 78.5 m-85 -100.52 176.49 5.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.292 0.568 . . . . 0.0 112.12 -178.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -173.73 168.72 4.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.71 179.641 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.472 HG11 ' CE2' ' A' ' 580' ' ' TRP . 0.1 OUTLIER -131.16 151.36 35.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.068 0.461 . . . . 0.0 111.634 -179.899 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.531 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 8.9 mmtt -140.7 123.24 16.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.151 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.46 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -79.42 132.88 36.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.096 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 591' ' ' GLY . 0.0 OUTLIER -119.97 144.99 47.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.779 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -107.57 166.83 10.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.127 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -88.24 34.65 0.74 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.191 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.517 ' HB3' ' OD1' ' A' ' 632' ' ' ASN . . . -140.11 4.74 2.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.058 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.93 30.99 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.773 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.517 ' OD1' ' HB3' ' A' ' 630' ' ' ALA . 0.0 OUTLIER -114.84 124.74 52.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.665 0.269 . . . . 0.0 110.788 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 12.4 p -116.45 134.53 59.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 111.244 179.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.46 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 21.4 p -76.89 -166.11 0.64 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.707 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.691 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -87.69 173.03 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.895 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.531 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -86.49 133.88 33.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.2 -179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.463 ' HB2' HG23 ' A' ' 624' ' ' VAL . 0.3 OUTLIER -63.46 178.74 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.922 179.783 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -57.01 149.23 19.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.384 179.601 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.64 129.0 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.429 . . . . 0.0 111.266 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.514 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.9 p -108.38 140.73 25.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.95 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.52 102.87 12.23 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.396 179.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.548 HG13 ' NE2' ' A' ' 571' ' ' GLN . 47.2 t -99.31 114.33 37.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.248 -179.494 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.07 101.07 10.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.613 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 68.3 p . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.201 -179.822 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 10.9 p80 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.856 0.36 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.7 -162.83 0.82 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.882 -179.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.477 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -60.58 146.48 85.39 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.002 -179.921 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.32 -159.72 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.457 2.105 . . . . 0.0 112.101 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.1 134.59 52.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.208 -179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.56 128.82 93.85 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.009 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.483 ' HG2' ' HB ' ' A' ' 624' ' ' VAL . 83.3 Cg_exo -45.23 136.65 10.88 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.697 2.265 . . . . 0.0 112.074 179.578 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 60.9 p -119.05 149.67 41.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.953 0.406 . . . . 0.0 111.7 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 10.0 m120 55.94 61.96 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.483 179.468 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.52 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 33.1 tp -65.71 159.17 25.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.298 179.467 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.52 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.03 177.24 10.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.035 0.445 . . . . 0.0 111.636 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . 0.468 ' HB2' ' NE2' ' A' ' 571' ' ' GLN . 0.0 OUTLIER -133.6 150.74 51.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.465 179.725 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 3.3 p -120.52 -90.35 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.447 -179.742 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.0 97.26 11.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.229 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.468 ' NE2' ' HB2' ' A' ' 568' ' ' SER . 1.5 mp0 -113.72 102.71 10.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.828 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 8.6 p -88.17 -162.96 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.239 -179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.65 19.0 7.89 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.661 -179.569 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.54 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 8.9 p -158.89 -44.74 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.79 0.329 . . . . 0.0 111.204 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 65.3 p -113.92 122.2 46.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 -179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.425 HG22 ' HB ' ' A' ' 611' ' ' ILE . 18.1 tt -109.17 138.03 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.168 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 14.3 m -112.9 116.11 29.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.631 179.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' A' ' 568' ' ' SER . 59.5 mt -103.73 156.5 17.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.947 0.403 . . . . 0.0 111.182 -179.702 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.1 p -145.0 138.91 27.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.04 179.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 624' ' ' VAL . 41.8 p90 -144.8 169.83 17.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.971 0.415 . . . . 0.0 111.52 -179.34 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.2 m -80.53 126.65 31.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.144 179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -60.21 163.4 4.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.6 t -88.08 133.06 34.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 -179.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.31 -8.16 37.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.183 179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.1 54.98 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.958 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -71.15 -135.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.674 179.852 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.1 t 52.6 20.6 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.149 0 CA-C-O 121.119 0.485 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -171.1 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.851 -179.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 57.8 t -65.25 117.55 6.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.764 0.316 . . . . 0.0 110.422 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 7.0 t -101.06 -35.41 9.36 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.56 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -158.03 178.44 34.31 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.216 -0.992 . . . . 0.0 113.223 -179.616 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -124.94 155.13 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.763 0.315 . . . . 0.0 110.857 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -131.39 117.8 19.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.422 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.446 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -99.68 143.81 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.916 0.388 . . . . 0.0 111.289 -179.575 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.56 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 92.1 m-85 -108.97 156.2 19.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.45 -179.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -118.19 84.04 2.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.152 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.51 -51.43 4.4 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.209 -179.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.11 -43.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.864 0.364 . . . . 0.0 111.125 179.873 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -80.06 172.39 13.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 1.2 tp -90.79 126.98 36.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.322 179.198 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.43 -107.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.859 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.413 HG22 HG13 ' A' ' 611' ' ' ILE . 2.9 t -91.54 164.95 13.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.216 0.532 . . . . 0.0 111.495 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -131.06 106.74 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.332 179.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.694 HG11 ' HA ' ' A' ' 609' ' ' ALA . 34.6 m -111.15 -177.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.638 -179.206 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.56 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.5 p -137.47 -20.08 1.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.795 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -81.15 -116.04 0.37 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.719 -179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.63 -5.12 2.88 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 -179.653 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.7 p -122.2 156.86 32.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.694 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -134.53 129.74 35.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.032 179.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.4 m -110.02 125.99 53.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.188 -179.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 576' ' ' ILE . 2.9 mp -111.04 136.46 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.955 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 82.2 p -113.88 178.0 4.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 -179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.24 36.19 92.91 Favored Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.447 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.7 OUTLIER -87.88 -174.23 4.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 110.992 -179.903 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -147.29 158.04 43.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.861 179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -88.91 157.32 18.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.213 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 55.66 43.37 28.22 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.089 179.973 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 10.7 m -140.31 144.13 36.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.457 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 2.9 p -90.58 140.48 29.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.262 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -135.12 122.66 22.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.828 0.347 . . . . 0.0 111.711 -179.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.58 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -102.88 105.51 15.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.91 178.852 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.409 ' O ' HG23 ' A' ' 623' ' ' THR . 74.1 m-85 -100.17 176.38 5.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.399 0.618 . . . . 0.0 112.442 -178.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.1 OUTLIER -170.18 155.5 5.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.619 179.669 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.483 ' HB ' ' HG2' ' A' ' 563' ' ' PRO . 0.1 OUTLIER -119.45 159.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.932 0.396 . . . . 0.0 111.538 -179.743 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.571 ' HE2' ' N ' ' A' ' 636' ' ' ALA . 7.2 mmtt -140.75 113.34 8.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.211 -179.546 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 633' ' ' VAL . . . -79.51 119.39 22.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.52 -179.638 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.418 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -117.83 166.43 12.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.784 179.817 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.15 164.23 20.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.61 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.63 57.38 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.044 179.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.97 -19.02 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.082 179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 113.09 26.15 4.18 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.269 -179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.477 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 4.4 m120 -121.81 121.25 36.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.748 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 626' ' ' ALA . 2.3 p -138.91 134.59 42.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.225 -179.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 0.2 OUTLIER -76.19 -176.5 3.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.828 179.908 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.472 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -74.68 176.17 7.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.044 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.571 ' N ' ' HE2' ' A' ' 625' ' ' LYS . . . -73.54 154.72 39.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.078 -179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.411 ' CB ' HG23 ' A' ' 624' ' ' VAL . 4.3 p -79.85 -163.27 0.51 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.758 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.79 146.99 41.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.98 23.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.928 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 621' ' ' THR . 7.5 p -102.9 134.53 43.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.262 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.5 m -109.32 105.92 15.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.337 179.697 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.24 130.32 63.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 643' ' ' LYS . 0.0 OUTLIER -96.45 121.66 38.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.83 179.906 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.102 -179.75 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 33.5 p-80 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.595 0.236 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 5.8 ttm 64.79 135.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.405 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.464 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -70.94 152.39 94.99 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.108 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.22 -165.76 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.642 2.228 . . . . 0.0 112.237 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.33 150.69 19.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.765 179.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.595 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -84.11 125.95 71.19 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.416 -179.748 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -48.31 154.57 2.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.686 2.257 . . . . 0.0 112.009 179.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.26 163.08 33.95 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.07 0.462 . . . . 0.0 111.664 -179.886 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 54.94 52.74 11.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.06 179.122 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.675 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 2.0 tp -74.23 156.95 36.7 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.051 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.675 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 -177.99 6.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.518 179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 83.9 p -133.76 129.04 36.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.653 179.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 76.1 p -111.43 -72.53 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.383 -179.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.26 96.3 10.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.351 . . . . 0.0 110.905 179.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 576' ' ' ILE . 0.7 OUTLIER -123.39 105.64 9.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 17.0 p -85.69 -155.2 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.919 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 16.0 m -88.04 -37.34 16.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 16.0 p -115.0 -2.61 12.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.669 0.271 . . . . 0.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -133.99 165.41 25.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.954 179.969 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 571' ' ' GLN . 16.4 tt -160.06 148.71 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.122 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.526 ' HA ' ' O ' ' A' ' 609' ' ' ALA . 4.9 m -132.66 124.03 27.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.659 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' A' ' 608' ' ' THR . 23.7 mt -107.47 153.28 23.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.398 . . . . 0.0 111.486 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.7 t -133.38 135.23 44.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.051 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.528 ' CZ2' HG11 ' A' ' 624' ' ' VAL . 46.5 p90 -143.48 169.89 16.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.473 -179.268 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 3.7 m -82.05 115.87 21.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.213 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . 0.429 ' HB2' HG22 ' A' ' 607' ' ' THR . . . -62.55 157.25 20.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.018 179.998 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.6 146.29 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.757 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 74.5 p -82.56 20.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.126 179.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -140.17 71.32 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -84.94 22.25 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.993 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 1.5 t -85.45 6.67 2.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.002 179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -155.85 -25.67 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.401 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.8 t -66.26 140.53 19.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.83 0.348 . . . . 0.0 111.173 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 22.3 p -115.48 -51.49 2.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.17 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.564 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -144.24 179.55 21.45 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.597 -179.947 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -131.28 120.36 23.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 111.016 -179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.521 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -99.75 122.17 42.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.419 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 624' ' ' VAL . 0.1 OUTLIER -102.01 138.17 27.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.971 0.415 . . . . 0.0 111.267 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.719 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 96.1 m-85 -99.27 162.04 13.27 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.655 179.912 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -140.32 88.96 2.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.657 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 62.55 69.02 1.42 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.995 -179.463 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p 50.23 35.02 9.59 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.008 0.432 . . . . 0.0 111.115 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -158.31 102.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.775 179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.71 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.6 OUTLIER -48.87 122.99 6.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.291 -179.654 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -92.89 -98.95 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.198 -179.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.4 t -90.8 169.07 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.133 0.492 . . . . 0.0 111.669 -179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.16 109.07 6.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.455 179.851 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.731 HG11 ' HA ' ' A' ' 609' ' ' ALA . 16.5 m -108.42 -170.59 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.789 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.564 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 32.0 p -140.51 2.47 1.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.834 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -115.1 -134.05 5.56 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.475 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.429 HG22 ' HB2' ' A' ' 582' ' ' ALA . 52.5 p -112.5 -4.03 14.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.768 0.318 . . . . 0.0 111.238 -179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.518 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.4 p -119.1 152.75 35.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.122 -179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.731 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -136.26 124.02 22.53 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.066 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 9.2 m -106.56 134.41 49.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.347 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.445 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.4 mp -121.01 138.6 50.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 14.1 m -117.76 162.36 18.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.793 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 66.49 79.1 0.22 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.321 -179.761 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 614' ' ' LEU . 1.2 tp -135.18 154.86 51.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 111.081 -179.755 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -92.05 163.36 14.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.059 -179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -89.52 156.9 18.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.912 179.869 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 2.6 p30 40.57 58.09 2.44 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.504 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . 0.446 ' HB ' ' CE2' ' A' ' 620' ' ' TYR . 3.6 m -134.29 148.68 50.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.077 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 78.9 p -87.06 130.21 34.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.746 179.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . 0.446 ' CE2' ' HB ' ' A' ' 618' ' ' THR . 69.5 m-85 -134.63 135.21 41.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.959 0.409 . . . . 0.0 111.645 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 43.3 p -114.62 128.13 56.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.857 178.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.483 ' O ' ' HA ' ' A' ' 639' ' ' ALA . 76.2 m-85 -120.08 168.94 10.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.458 0.647 . . . . 0.0 112.274 -178.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -167.42 152.67 7.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.314 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.56 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -118.97 155.86 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 112.266 -179.266 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.719 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 5.7 mmtp -140.77 142.68 34.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.757 -179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.54 ' HB3' ' OG ' ' A' ' 634' ' ' SER . . . -101.33 128.2 47.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.489 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.52 140.29 50.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 179.65 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.61 167.99 9.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.75 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -66.36 -31.32 72.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.89 -179.265 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.2 10.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.569 -179.38 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 76.81 69.82 1.35 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.508 179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 71.6 m-80 -148.2 124.04 10.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.685 0.278 . . . . 0.0 110.742 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 626' ' ' ALA . 25.7 m -112.59 139.44 37.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.044 0.45 . . . . 0.0 111.693 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.54 ' OG ' ' HB3' ' A' ' 626' ' ' ALA . 2.0 p -83.8 -164.93 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.248 179.592 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.595 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -81.94 161.33 23.11 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.73 0.3 . . . . 0.0 110.814 179.657 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.639 ' N ' ' HE3' ' A' ' 625' ' ' LYS . . . -74.1 144.23 45.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.865 179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.416 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.2 OUTLIER -72.15 -163.17 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.19 -179.871 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.27 142.09 34.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.844 179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.483 ' HA ' ' O ' ' A' ' 622' ' ' PHE . . . -79.65 116.22 19.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.065 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 621' ' ' THR . 11.6 p -101.03 131.82 47.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.129 -179.942 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 45.8 t -106.28 113.78 27.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.1 147.75 26.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.432 -179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -111.46 116.07 30.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.856 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.183 179.967 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.603 0.239 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 12.3 mmt 67.14 -75.2 0.06 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.2 179.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -48.24 134.49 12.38 Favored Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.359 -179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -83.34 -158.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.731 2.288 . . . . 0.0 112.447 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 3.4 m -115.91 133.94 55.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.067 179.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -64.54 127.33 92.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.247 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -49.36 163.63 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.737 2.292 . . . . 0.0 112.003 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.2 t -155.07 158.43 39.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.366 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.2 m120 58.36 49.63 10.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.287 179.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.797 HD11 ' HG ' ' A' ' 578' ' ' LEU . 6.1 tp -71.16 158.49 36.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.306 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.641 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -160.46 174.51 13.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 0.0 111.475 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -129.9 142.8 50.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.619 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.13 -78.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.277 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . 0.532 ' HB3' ' OG1' ' A' ' 577' ' ' THR . . . -88.67 96.53 10.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.186 -179.804 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.03 97.6 6.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.92 179.873 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 61.1 p -92.63 -163.61 1.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.023 179.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 46.2 p -90.52 24.97 2.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.353 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 614' ' ' LEU . 24.9 p -163.83 -49.5 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.017 179.767 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -101.06 160.14 14.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.945 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.458 ' CG2' ' HB ' ' A' ' 611' ' ' ILE . 16.5 tt -151.18 137.08 11.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.926 0.394 . . . . 0.0 111.176 179.751 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . 0.532 ' OG1' ' HB3' ' A' ' 570' ' ' ALA . 4.8 m -106.17 131.36 53.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.567 179.63 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.797 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.7 OUTLIER -120.81 128.24 52.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.532 -179.208 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.6 t -123.73 128.34 49.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.405 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.599 ' CD2' HG11 ' A' ' 624' ' ' VAL . 44.6 p90 -140.64 170.21 16.2 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.959 0.409 . . . . 0.0 111.456 -179.355 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 11.3 m -79.6 123.02 27.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.143 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.58 162.63 8.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.22 -179.928 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 7.4 m -71.46 158.2 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 17.45 3.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.147 179.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.614 ' O ' HG23 ' A' ' 589' ' ' VAL . 1.6 t70 -138.5 44.22 2.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.799 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -60.79 -12.87 12.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.162 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.7 -9.92 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.041 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -131.0 -29.82 0.6 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.569 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 585' ' ' ASP . 7.4 t -65.31 145.48 13.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.644 0.259 . . . . 0.0 110.874 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 1.4 t -117.64 -34.32 4.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.477 -179.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.716 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -157.46 169.43 34.4 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.415 -0.897 . . . . 0.0 113.16 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 74.6 m-85 -122.63 126.15 47.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.727 0.298 . . . . 0.0 110.763 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 1.3 m-20 -101.54 116.62 33.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.632 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.62 HG13 ' HB ' ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.32 139.95 19.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.982 0.42 . . . . 0.0 111.106 -179.599 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -102.21 146.58 27.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.278 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.472 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 0.2 OUTLIER -101.67 84.59 2.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.179 179.105 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 86.13 -55.82 4.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.349 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 5.5 p -147.56 -56.91 0.24 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.774 0.321 . . . . 0.0 111.033 179.86 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -79.69 174.12 11.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.02 154.15 25.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.906 0.384 . . . . 0.0 110.986 -179.944 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -141.08 -68.68 0.39 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.135 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.62 ' HB ' HG13 ' A' ' 594' ' ' VAL . 0.1 OUTLIER -90.76 154.88 19.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.133 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.23 89.34 2.28 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.423 178.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.808 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.9 m -104.03 -176.03 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.613 -179.322 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.716 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 16.6 p -144.41 -11.56 0.62 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.111 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -96.91 -137.67 9.65 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.628 -179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.89 10.05 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.641 0.258 . . . . 0.0 111.396 -179.828 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 0.1 OUTLIER -137.11 165.55 25.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.315 -179.902 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.808 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -141.8 150.91 42.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.158 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 30.6 m -134.43 118.33 17.28 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.303 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.458 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.5 mp -117.88 111.81 35.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.064 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.0 154.01 21.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.988 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 98.64 33.64 5.53 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.601 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 574' ' ' SER . 3.6 mt -107.58 155.8 19.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.783 0.325 . . . . 0.0 110.955 179.964 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -106.68 159.97 15.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.95 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.02 179.58 5.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.401 -179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.18 28.39 17.68 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.077 179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.15 150.47 44.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.468 -179.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 75.3 m -100.64 121.08 41.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.29 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -114.46 129.39 56.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.993 0.425 . . . . 0.0 111.897 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.575 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.5 OUTLIER -108.75 121.91 46.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.787 178.907 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -111.23 165.15 12.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.381 0.61 . . . . 0.0 112.395 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 7.0 p -150.44 149.99 30.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.709 179.27 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.599 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -117.01 152.78 18.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.955 0.407 . . . . 0.0 111.523 -179.769 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 8.7 mttt -140.62 139.79 34.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.204 -179.654 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -99.04 121.96 41.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.449 ' H ' ' HG3' ' A' ' 627' ' ' LYS . 0.0 OUTLIER -118.84 140.46 49.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.987 -179.813 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . 0.446 ' OD1' HG22 ' A' ' 589' ' ' VAL . 9.1 m-20 -105.2 175.01 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.893 179.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -84.95 15.29 4.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.293 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -113.26 6.45 17.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.976 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 80.11 9.9 86.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.475 -179.909 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -102.14 125.38 48.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 110.856 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 7.7 p -126.89 137.94 56.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.093 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.1 -167.49 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.163 -179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -80.08 178.9 7.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.061 -179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.483 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.2 146.86 23.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.05 179.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.422 ' CB ' HG23 ' A' ' 624' ' ' VAL . 1.1 t -79.09 174.71 11.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.97 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 16.1 t30 -59.3 148.29 32.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.801 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -81.3 126.67 31.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.575 ' O ' ' HA ' ' A' ' 621' ' ' THR . 5.3 p -99.5 134.11 39.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.554 179.702 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -103.87 113.34 26.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.896 0.379 . . . . 0.0 111.056 -179.398 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.409 HG21 ' CD1' ' A' ' 576' ' ' ILE . 0.4 OUTLIER -122.95 131.34 73.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.901 179.826 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.39 113.99 25.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.884 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.2 -179.93 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . 0.41 ' N ' ' HD1' ' A' ' 557' ' ' HIS . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.699 0.285 . . . . 0.0 111.202 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -126.09 -48.35 1.61 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.003 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.435 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -63.54 151.95 86.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.014 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -68.5 -172.66 0.47 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.527 2.151 . . . . 0.0 112.311 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 18.2 p -99.93 135.45 41.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.405 -179.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.419 ' HB2' ' HB3' ' A' ' 634' ' ' SER . . . -64.12 132.24 95.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.128 179.769 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.439 ' HB2' ' HB2' ' A' ' 637' ' ' SER . 81.0 Cg_exo -45.47 153.74 0.63 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.616 2.21 . . . . 0.0 112.226 179.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.29 151.05 44.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.943 0.401 . . . . 0.0 111.62 -179.577 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 59.39 59.71 2.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.969 179.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.715 HD11 ' HG ' ' A' ' 578' ' ' LEU . 63.9 tp -74.83 159.95 31.28 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.417 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.34 173.35 15.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.021 0.438 . . . . 0.0 111.934 -179.657 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.71 129.11 36.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.307 179.381 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 1.8 p -106.36 -84.23 0.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 111.643 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -87.8 96.92 10.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.461 -179.426 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.537 ' NE2' ' HA ' ' A' ' 644' ' ' THR . 1.8 tt0 -116.0 101.65 8.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.793 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.5 p -90.78 -157.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.072 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 40.5 p -95.24 25.21 4.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.465 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 78.8 p -167.36 -50.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.278 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.55 131.54 53.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.146 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.64 HD12 HG11 ' A' ' 642' ' ' VAL . 10.0 tt -121.99 143.31 35.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 28.3 m -107.15 117.01 32.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.579 179.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.9 OUTLIER -108.63 134.99 50.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.149 -179.526 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 3.4 t -130.01 136.52 49.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.474 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.1 p90 -148.59 169.78 19.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.902 0.382 . . . . 0.0 111.122 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 5.5 m -82.14 116.52 21.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.963 179.684 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.25 155.25 21.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.048 179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.4 m -59.46 120.61 9.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.79 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.6 -15.96 61.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.288 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.9 -66.14 0.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.865 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.484 ' O ' HG12 ' A' ' 587' ' ' VAL . 49.5 t30 57.71 -133.69 1.19 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.772 -179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.484 HG12 ' O ' ' A' ' 586' ' ' ASN . 3.8 p 45.1 23.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.118 0.485 . . . . 0.0 111.655 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -178.44 -21.13 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.084 179.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . . . . . . . . . 16.7 t -76.34 134.18 29.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.789 0.328 . . . . 0.0 110.713 179.709 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.89 -48.22 4.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.314 -179.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -151.12 -179.35 26.77 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.87 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -126.42 132.5 51.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.671 0.272 . . . . 0.0 110.904 -179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.36 123.19 48.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.389 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.86 137.57 26.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.889 0.376 . . . . 0.0 111.228 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.413 ' HE2' ' HG3' ' A' ' 625' ' ' LYS . 93.0 m-85 -99.47 145.39 27.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.513 ' HB2' ' HB2' ' A' ' 601' ' ' ALA . 2.9 t-20 -114.92 89.74 3.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.368 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 81.56 -70.9 3.02 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.129 -179.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 9.5 p -148.11 -16.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.865 0.364 . . . . 0.0 110.888 179.73 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -115.53 134.75 54.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.79 179.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.403 ' HG ' ' N ' ' A' ' 601' ' ' ALA . 0.6 OUTLIER -48.35 147.67 2.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.345 -179.747 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.513 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -115.33 -106.65 0.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.173 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 6.5 t -90.92 168.07 11.96 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.205 0.526 . . . . 0.0 111.854 -179.721 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 88.7 m -128.92 130.84 47.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.313 179.756 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.779 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.6 m -132.77 -177.7 2.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.501 -179.365 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.521 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 34.7 p -145.53 17.67 1.49 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.974 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -128.05 -121.85 2.44 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.761 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.95 9.3 5.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.627 0.251 . . . . 0.0 111.41 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.523 ' O ' HG11 ' A' ' 604' ' ' VAL . 1.1 p -139.72 140.08 36.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.36 -179.879 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.779 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -122.48 148.0 45.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 2.5 m -122.01 109.08 14.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.278 -179.896 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.462 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 2.7 mp -102.34 126.71 56.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.096 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 164.97 13.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.864 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.85 47.78 5.18 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.473 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . . . . . . . . . 12.5 mt -119.38 152.25 37.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 110.918 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.7 152.12 35.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.151 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -77.93 174.91 10.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.947 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.4 t0 56.86 25.55 10.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.14 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.72 161.57 32.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.054 179.827 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 47.5 t -121.94 137.28 54.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.82 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -135.62 172.54 12.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.943 0.401 . . . . 0.0 111.491 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.55 110.65 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.105 179.496 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.408 ' O ' HG23 ' A' ' 623' ' ' THR . 78.6 m-85 -99.73 165.65 11.49 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.227 0.537 . . . . 0.0 111.959 -178.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.408 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.8 OUTLIER -159.62 153.07 22.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.882 179.628 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.474 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -118.57 150.12 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.924 0.392 . . . . 0.0 111.345 -179.763 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.413 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.3 mttt -136.0 150.16 49.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.083 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -106.26 129.27 54.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.223 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.637 ' HB3' HG12 ' A' ' 633' ' ' VAL . 1.9 ptmm? -127.78 142.62 51.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.28 169.72 8.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 179.848 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -85.62 48.7 1.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -159.74 3.1 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.084 179.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 84.84 61.81 1.74 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.458 179.948 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 10.8 m120 -145.48 106.98 4.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.646 179.934 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . 0.637 HG12 ' HB3' ' A' ' 627' ' ' LYS . 29.4 m -118.82 137.98 51.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.378 -179.823 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.419 ' HB3' ' HB2' ' A' ' 562' ' ' ALA . 0.2 OUTLIER -87.95 -167.0 1.74 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.718 179.808 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -73.0 170.95 13.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.875 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.409 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.14 138.78 33.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.78 179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.465 ' CB ' HG23 ' A' ' 624' ' ' VAL . 0.9 OUTLIER -63.51 179.93 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.234 -179.847 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.24 148.44 27.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.69 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -82.97 128.39 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.003 -179.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 4.3 m -109.73 115.08 48.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.268 -179.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 19.6 m -79.81 100.95 8.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.287 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.64 HG11 HD12 ' A' ' 576' ' ' ILE . 63.6 t -99.86 108.79 23.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.37 -179.458 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.71 95.0 8.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.665 179.757 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . 0.537 ' HA ' ' NE2' ' A' ' 571' ' ' GLN . 19.8 p . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.18 -179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.715 0.293 . . . . 0.0 111.128 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 11.8 mtm 56.56 23.75 7.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.073 179.893 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -89.46 152.64 47.65 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.222 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.45 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.562 2.175 . . . . 0.0 111.958 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.831 HG23 ' HB2' ' A' ' 585' ' ' ASP . 2.2 p -107.52 136.88 46.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.889 0.376 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.423 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -67.18 129.9 93.78 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.305 -179.783 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.458 ' HB2' ' HB3' ' A' ' 637' ' ' SER . 85.3 Cg_exo -47.28 152.48 2.21 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.729 2.286 . . . . 0.0 111.854 179.277 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.96 161.76 34.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.34 -179.652 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 61.1 34.05 19.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.938 179.639 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.779 HD21 HD22 ' A' ' 578' ' ' LEU . 1.6 tm? -69.15 117.51 10.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.117 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.494 ' N ' HD22 ' A' ' 566' ' ' LEU . . . -144.74 145.97 31.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.232 -179.821 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 2.1 p -84.83 150.74 24.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.817 179.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 6.2 p -124.29 -86.43 0.63 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.277 -179.829 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.9 99.46 12.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.014 -179.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.485 ' HG3' HD12 ' A' ' 576' ' ' ILE . 1.6 tt0 -119.43 140.13 50.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.043 -179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 36.5 p -128.45 -167.85 1.83 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.895 179.792 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 6.1 p -87.38 32.98 0.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.189 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.487 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 23.2 p -169.46 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.315 179.938 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.0 OUTLIER -110.69 135.97 50.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.248 -179.677 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.485 HD12 ' HG3' ' A' ' 571' ' ' GLN . 13.8 tt -127.71 139.32 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.78 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 20.7 m -110.27 122.2 47.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.135 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.779 HD22 HD21 ' A' ' 566' ' ' LEU . 13.1 mt -109.1 141.47 41.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.969 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.5 t -132.29 133.54 44.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.559 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -144.76 169.66 17.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.198 -179.599 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.7 m -84.69 128.25 34.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.199 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -59.06 150.24 25.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.047 179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 94.5 p -61.49 150.19 36.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.899 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 30.7 p -85.61 11.64 10.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.01 179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.831 ' HB2' HG23 ' A' ' 561' ' ' THR . 0.4 OUTLIER -119.38 45.08 2.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.053 179.923 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.44 ' C ' ' H ' ' A' ' 588' ' ' GLY . 73.1 m-20 -65.11 -164.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.962 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 11.2 t 66.41 -4.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 121.118 0.485 . . . . 0.0 110.906 -179.771 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 586' ' ' ASN . . . -142.24 -16.84 0.32 Allowed Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 585' ' ' ASP . 89.3 t -82.49 146.57 6.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.67 0.272 . . . . 0.0 110.781 179.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 591' ' ' GLY . 1.3 t -106.08 -54.41 2.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.638 -179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 605' ' ' THR . . . -151.71 -172.21 20.28 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.402 -0.904 . . . . 0.0 113.137 -179.563 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -131.01 129.26 41.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.791 0.329 . . . . 0.0 110.586 -179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.18 117.67 34.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.858 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.548 HG13 HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -99.83 137.01 28.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.804 -179.892 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 33.9 m-85 -101.9 175.06 5.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.315 -179.444 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.45 HD21 ' HD1' ' A' ' 620' ' ' TYR . 6.7 t-20 -140.48 89.3 2.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.737 179.666 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 85.32 -68.84 3.38 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.305 -179.736 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.406 ' H ' ' H ' ' A' ' 599' ' ' ALA . 1.1 p -150.3 -18.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.902 0.382 . . . . 0.0 110.638 179.782 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.406 ' H ' ' H ' ' A' ' 598' ' ' THR . . . -114.6 135.25 54.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.742 179.545 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.6 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 1.1 tp -51.94 144.22 12.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.218 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.44 ' HB2' ' HB2' ' A' ' 596' ' ' ASN . . . -110.96 -98.46 0.41 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.101 179.923 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.548 HG23 HG13 ' A' ' 594' ' ' VAL . 2.9 t -90.83 160.2 15.87 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.108 0.48 . . . . 0.0 111.645 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 15.9 m -125.97 122.62 36.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.167 179.551 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.755 HG11 ' HA ' ' A' ' 609' ' ' ALA . 30.1 m -127.83 -174.74 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.062 0.458 . . . . 0.0 111.998 -178.918 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.523 HG22 ' HA3' ' A' ' 591' ' ' GLY . 6.2 p -146.59 -2.29 0.66 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.889 179.843 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -110.49 -134.15 6.64 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.717 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.47 30.16 7.08 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.776 0.322 . . . . 0.0 111.242 -179.836 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.489 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.0 OUTLIER -157.77 141.17 15.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.215 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.755 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -123.78 155.97 36.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.81 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . . . . . . . . . 16.6 m -137.06 124.51 22.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.241 -179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.449 ' HB ' ' CG2' ' A' ' 576' ' ' ILE . 4.7 mp -113.68 128.34 70.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.17 -179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.96 171.08 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.699 179.832 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 61.02 64.81 3.74 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.675 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 574' ' ' SER . 0.4 OUTLIER -115.51 132.44 56.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.828 0.347 . . . . 0.0 110.868 -179.989 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -99.44 134.72 41.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.116 -179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -70.12 168.23 16.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 16.2 t0 59.66 29.08 18.63 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.019 179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.9 m -134.79 142.23 46.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.168 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 26.3 t -84.09 143.66 29.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.738 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . 0.45 ' HD1' HD21 ' A' ' 596' ' ' ASN . 59.8 m-85 -136.87 142.35 42.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.151 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 2.4 p -132.57 114.2 13.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.289 179.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.546 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 81.3 m-85 -109.13 166.88 10.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.283 0.563 . . . . 0.0 111.905 -179.203 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 622' ' ' PHE . 0.2 OUTLIER -169.26 127.17 0.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.693 179.603 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.526 HG23 ' HG ' ' A' ' 566' ' ' LEU . 0.6 OUTLIER -99.36 149.55 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.13 0.491 . . . . 0.0 111.926 -179.056 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 636' ' ' ALA . 7.1 mttt -128.24 166.36 18.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.332 179.737 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -116.06 123.78 48.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 111.111 -179.898 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -121.38 154.44 36.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.829 -179.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.81 171.74 7.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.861 179.914 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -81.57 47.69 1.09 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.361 -179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -153.92 -30.85 0.12 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.056 179.86 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 125.11 28.25 1.14 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.573 179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -112.7 120.29 41.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.77 0.319 . . . . 0.0 110.702 179.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 5.4 p -120.7 147.75 24.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.33 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 1.3 t -89.95 -154.66 0.33 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.524 179.68 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.423 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -84.0 -179.5 7.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 179.725 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.548 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.15 140.3 29.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.88 0.371 . . . . 0.0 111.023 179.943 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.458 ' HB3' ' HB2' ' A' ' 563' ' ' PRO . 4.9 p -68.45 -172.62 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.014 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.71 145.37 52.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.747 179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.421 ' HA ' HG23 ' A' ' 623' ' ' THR . . . -80.17 119.19 22.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.167 -179.902 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.546 ' CG1' ' HB2' ' A' ' 622' ' ' PHE . 7.3 p -101.12 123.95 54.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.041 179.855 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 5.3 t -105.58 106.14 16.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.862 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 620' ' ' TYR . 0.1 OUTLIER -113.36 125.45 70.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.259 179.991 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.92 101.68 12.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 70.9 p . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.254 -179.963 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 17.7 m80 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.857 0.36 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 9.3 mmt -112.46 -62.82 1.52 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.082 179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.472 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -56.47 148.08 46.18 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.406 -179.756 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.506 ' HB3' HG22 ' A' ' 589' ' ' VAL . 69.1 Cg_endo -74.09 -168.74 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.512 2.141 . . . . 0.0 111.817 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.765 ' HB ' ' HB2' ' A' ' 583' ' ' SER . 70.2 m -109.81 113.27 25.87 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.173 179.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.33 64.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.737 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 626' ' ' ALA . 86.4 Cg_exo -46.98 160.33 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.602 2.201 . . . . 0.0 112.381 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 7.8 t -155.28 157.81 37.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.555 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 11.3 t30 58.46 43.16 19.97 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.432 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.759 HD11 ' HG ' ' A' ' 578' ' ' LEU . 51.7 tp -61.45 160.58 10.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.303 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.441 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.21 173.7 14.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 111.774 -179.83 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.6 p -126.13 136.31 52.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.544 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 11.6 p -110.65 -86.88 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.534 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -89.16 98.5 11.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.819 0.342 . . . . 0.0 111.348 -179.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.409 ' HB3' HG13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -117.12 104.09 10.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.844 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 30.8 p -103.83 -170.08 1.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 71.5 p -91.74 41.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.228 -179.918 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . . . . . . . . . 15.6 p -168.65 -42.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.259 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.8 OUTLIER -135.28 137.47 42.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.136 -179.665 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.594 HG22 ' HB ' ' A' ' 611' ' ' ILE . 13.7 tt -118.67 142.48 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.247 179.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 1.5 m -110.82 121.63 45.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.622 179.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.759 ' HG ' HD11 ' A' ' 566' ' ' LEU . 1.3 tp -111.36 136.08 51.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.085 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 2.3 t -130.94 135.38 47.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.354 179.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.613 ' CD2' HG11 ' A' ' 624' ' ' VAL . 36.4 p90 -143.71 170.18 16.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.985 0.421 . . . . 0.0 111.428 -179.334 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 1.8 m -79.45 116.65 19.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.019 179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 607' ' ' THR . . . -60.74 170.06 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.266 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.765 ' HB2' ' HB ' ' A' ' 561' ' ' THR . 2.6 p -88.33 138.91 31.02 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.996 -179.967 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -13.94 62.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.337 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 589' ' ' VAL . 27.9 m-20 -110.03 59.23 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.846 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -78.24 5.2 10.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.005 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 12.2 p -67.57 -18.98 24.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.799 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -120.79 -24.98 2.43 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.474 179.901 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 560' ' ' PRO . 3.5 t -69.6 133.85 31.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.906 180.0 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 2.9 t -120.28 0.52 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.439 -179.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.644 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 170.63 162.81 23.61 Favored Glycine 0 C--N 1.331 0.277 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.253 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -122.05 145.56 48.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.811 0.338 . . . . 0.0 110.746 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.581 ' HB3' HD11 ' A' ' 600' ' ' LEU . 0.2 OUTLIER -123.03 124.54 43.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.723 179.891 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.553 ' CG1' HG23 ' A' ' 602' ' ' THR . 0.2 OUTLIER -101.18 132.6 46.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.035 0.445 . . . . 0.0 111.032 -179.942 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.743 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 97.3 m-85 -99.74 149.31 23.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.954 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -131.35 100.4 5.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.757 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.9 69.52 1.24 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.332 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 68.1 p 48.41 29.51 2.02 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.925 0.393 . . . . 0.0 111.353 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -154.8 103.75 2.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.599 179.737 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.743 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 0.7 OUTLIER -48.47 139.4 9.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.526 -179.451 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -107.38 -94.65 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.792 179.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.553 HG23 ' CG1' ' A' ' 594' ' ' VAL . 0.9 OUTLIER -91.07 163.13 14.41 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.111 0.481 . . . . 0.0 111.443 179.83 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 99.57 4.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.421 179.811 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.73 HG11 ' HA ' ' A' ' 609' ' ' ALA . 35.2 m -103.16 -167.88 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.648 -179.203 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.644 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 66.0 p -143.51 -24.03 0.59 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.014 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -83.33 -124.6 0.98 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.618 -179.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 582' ' ' ALA . 0.5 OUTLIER -126.21 9.54 7.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 111.12 -179.875 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.551 ' O ' HG11 ' A' ' 604' ' ' VAL . 0.1 OUTLIER -131.19 157.63 42.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.246 -179.998 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.73 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -144.46 142.7 30.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.583 179.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.5 OUTLIER -125.24 131.2 53.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.557 -179.697 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.594 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.2 mp -115.83 130.39 70.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.131 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 3.2 p -99.37 -178.07 3.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.783 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 56.44 45.7 88.84 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.37 -179.814 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 614' ' ' LEU . 6.1 tp -97.66 148.06 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 111.133 -179.769 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -117.74 165.55 13.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.906 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.13 174.04 7.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.362 -179.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 43.32 44.04 4.49 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.946 179.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.16 151.55 45.35 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.281 179.53 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -108.63 132.54 53.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.536 179.618 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -126.6 136.87 53.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.91 0.386 . . . . 0.0 111.411 -179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -108.37 116.26 31.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.087 179.094 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -114.0 163.6 14.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.255 0.55 . . . . 0.0 112.233 -178.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -155.72 147.18 22.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.645 179.394 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.613 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -109.95 152.65 11.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.17 0.51 . . . . 0.0 111.64 -179.625 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.565 ' HG3' ' HE1' ' A' ' 595' ' ' TYR . 4.9 mmtt -135.79 145.68 46.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.089 -179.531 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.484 ' HB2' ' HD3' ' A' ' 563' ' ' PRO . . . -109.98 115.68 30.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.435 ' HD3' ' OD1' ' A' ' 593' ' ' ASP . 2.0 pttm -117.95 152.1 36.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.111 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -99.74 -159.3 0.73 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.205 179.561 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -51.56 -76.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.071 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -160.86 48.51 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.466 179.954 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -148.18 -66.06 0.01 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.42 -179.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 7.8 m120 -89.89 145.11 25.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.205 0.526 . . . . 0.0 111.811 -179.091 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.2 t -137.95 135.74 45.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 179.35 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 626' ' ' ALA . 0.6 OUTLIER -89.15 173.88 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.178 -179.513 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.444 ' C ' ' HE2' ' A' ' 625' ' ' LYS . . . -82.39 171.65 13.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.212 -179.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.484 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -81.14 143.36 32.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.1 179.942 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.4 -174.45 3.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -70.55 152.0 44.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.562 179.744 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -80.71 149.42 29.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.026 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.12 111.05 23.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.373 -179.888 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 13.0 t -89.29 112.57 23.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.68 179.879 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -112.28 140.52 31.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.09 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.34 100.79 10.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.845 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.162 -0.923 . . . . 0.0 111.102 179.977 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.609 0.242 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . 0.43 ' HB3' ' H ' ' A' ' 559' ' ' ALA . 0.0 OUTLIER 57.52 -154.34 0.35 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.249 179.864 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.43 ' H ' ' HB3' ' A' ' 558' ' ' MET . . . -57.17 147.47 56.59 Favored Pre-proline 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.347 -179.761 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.418 ' HB2' ' H ' ' A' ' 561' ' ' THR . 86.9 Cg_endo -83.27 -140.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.695 2.263 . . . . 0.0 112.137 179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.418 ' H ' ' HB2' ' A' ' 560' ' ' PRO . 0.2 OUTLIER -115.34 122.27 45.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.806 0.336 . . . . 0.0 110.853 179.661 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.16 129.88 86.55 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.282 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.46 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 87.7 Cg_exo -45.8 125.39 8.01 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.66 2.24 . . . . 0.0 111.887 179.561 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 2.8 t -109.53 149.83 29.06 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.637 -179.431 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 2.3 m120 57.41 78.39 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.796 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.513 ' HG ' ' N ' ' A' ' 567' ' ' ALA . 36.9 tp -90.35 159.27 16.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.303 179.118 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.513 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.61 14.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.974 0.416 . . . . 0.0 111.649 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 77.6 p -124.65 143.26 50.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.326 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.31 -89.84 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.714 0.292 . . . . 0.0 111.77 -179.532 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -81.71 103.15 11.2 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.602 -179.422 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.7 134.56 54.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.757 179.7 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.403 ' HB ' ' H ' ' A' ' 573' ' ' THR . 18.5 p -129.62 -161.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.793 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.403 ' H ' ' HB ' ' A' ' 572' ' ' THR . 16.7 p -96.77 27.49 3.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.166 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 88.5 p -168.65 -40.0 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.333 179.985 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.1 OUTLIER -115.99 153.33 31.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.237 -179.651 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.556 HG22 ' HB ' ' A' ' 611' ' ' ILE . 19.4 tt -144.78 149.11 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.912 179.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 71.2 m -128.36 111.61 13.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.909 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.547 ' O ' ' HA ' ' A' ' 608' ' ' THR . 91.9 mt -100.45 141.46 33.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.102 -179.793 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 607' ' ' THR . 22.6 t -124.8 140.43 52.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.394 179.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.46 ' CD1' ' HB3' ' A' ' 563' ' ' PRO . 48.3 p90 -154.55 169.79 22.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.11 -179.568 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 17.4 m -84.55 122.38 28.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.862 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -57.17 160.49 3.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.147 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.2 m -56.72 158.91 4.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 32.2 p -96.97 12.79 31.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.573 -179.534 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.469 ' OD2' HG23 ' A' ' 589' ' ' VAL . 5.8 p-10 -105.78 -57.98 1.97 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.143 179.892 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.409 ' N ' ' CG ' ' A' ' 585' ' ' ASP . 0.1 OUTLIER 48.98 24.13 0.82 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.783 0.325 . . . . 0.0 111.364 179.914 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.466 HG22 ' HB2' ' A' ' 585' ' ' ASP . 12.5 m -98.31 -2.86 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.052 0.453 . . . . 0.0 110.995 -179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -165.0 -8.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.844 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.469 HG23 ' OD2' ' A' ' 585' ' ' ASP . 16.4 t -65.27 128.75 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.866 0.365 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.78 -30.5 5.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.277 -179.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.69 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -161.67 174.26 38.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.729 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -125.98 125.79 43.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.867 0.365 . . . . 0.0 110.905 -179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.504 ' OD1' HD11 ' A' ' 600' ' ' LEU . 2.3 m-20 -100.03 119.11 37.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.6 179.829 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -99.83 135.41 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.006 0.432 . . . . 0.0 111.185 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.697 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 84.2 m-85 -99.88 129.71 45.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.982 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . 0.429 ' HB3' ' HB2' ' A' ' 601' ' ' ALA . 21.7 t30 -109.93 89.16 2.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.586 179.649 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 68.45 72.34 0.83 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.497 -179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 27.0 p 46.66 30.04 1.07 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.952 0.406 . . . . 0.0 111.334 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.07 106.6 1.8 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.763 -179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.697 ' HA ' ' HA ' ' A' ' 595' ' ' TYR . 7.7 tt -47.1 138.81 6.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.449 -179.641 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . 0.429 ' HB2' ' HB3' ' A' ' 596' ' ' ASN . . . -114.39 -92.11 0.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.0 179.816 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 13.6 t -90.69 168.01 12.09 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.256 0.551 . . . . 0.0 111.676 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 43.5 m -138.61 108.5 6.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.348 -179.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.701 HG11 ' HA ' ' A' ' 609' ' ' ALA . 13.3 m -105.86 -168.17 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.351 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.69 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 19.4 p -143.06 -12.38 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -104.82 -135.49 8.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.549 179.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . 0.446 ' O ' ' HA ' ' A' ' 579' ' ' SER . 70.2 p -111.3 5.13 19.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.775 0.321 . . . . 0.0 111.238 -179.896 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.547 ' HA ' ' O ' ' A' ' 578' ' ' LEU . 2.3 p -115.38 164.14 14.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.701 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -150.93 115.85 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.733 0.301 . . . . 0.0 111.11 -179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 1.6 m -102.56 121.37 42.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.154 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.556 ' HB ' HG22 ' A' ' 576' ' ' ILE . 3.0 mt -120.7 121.77 66.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 -179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 80.2 p -101.01 174.6 5.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.774 179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 64.89 58.38 10.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.362 -179.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.1 OUTLIER -120.21 133.36 55.5 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.861 0.362 . . . . 0.0 110.908 -179.759 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -74.58 160.91 30.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.232 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.11 147.01 23.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.002 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 52.97 52.95 12.84 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.941 179.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 2.1 m -134.34 142.4 47.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.175 -179.791 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 1.8 t -79.72 137.44 37.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.45 179.752 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -139.17 134.61 33.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.476 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.459 HG22 ' HB1' ' A' ' 639' ' ' ALA . 0.2 OUTLIER -115.84 113.48 23.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.043 179.119 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . 0.473 ' HB2' ' CG1' ' A' ' 640' ' ' VAL . 63.1 m-85 -108.14 160.77 15.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.355 0.598 . . . . 0.0 112.372 -178.731 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.86 130.36 8.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.834 179.557 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.48 ' CG2' HD13 ' A' ' 566' ' ' LEU . 0.1 OUTLIER -99.61 152.03 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.168 0.509 . . . . 0.0 111.724 -179.242 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.573 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 11.6 mttt -140.73 142.3 34.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.986 -179.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -102.19 122.92 45.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.127 -179.945 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . 0.452 ' HD3' ' OD2' ' A' ' 593' ' ' ASP . 0.8 OUTLIER -114.35 149.88 35.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 179.825 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -105.76 -179.17 3.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -90.2 37.14 0.89 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.864 179.77 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -144.23 6.3 1.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 82.62 16.45 70.75 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.457 -179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.49 111.59 24.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.746 0.308 . . . . 0.0 110.789 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 10.6 p -110.34 144.38 18.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.242 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -78.9 -162.36 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.012 -179.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . . . . . . . . . . . -81.84 178.39 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.103 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -90.33 147.45 23.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.294 -179.818 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . 0.435 ' CB ' HG23 ' A' ' 624' ' ' VAL . 8.2 t -78.61 -177.11 5.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.755 179.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.09 142.71 58.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.535 179.682 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.459 ' HB1' HG22 ' A' ' 621' ' ' THR . . . -79.93 120.01 23.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.955 -179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.527 HG22 HG13 ' A' ' 642' ' ' VAL . 7.5 p -100.26 126.88 53.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.186 -179.944 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.32 93.17 4.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.479 179.801 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.527 HG13 HG22 ' A' ' 640' ' ' VAL . 15.5 m -99.72 155.45 4.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.238 -179.725 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.26 118.15 33.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.768 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.081 179.945 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 36.1 m80 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.73 0.3 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -122.53 -61.27 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.696 179.769 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . . . . . . . . . . . -65.48 149.82 96.71 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.819 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.589 ' HB3' HG22 ' A' ' 589' ' ' VAL . 27.8 Cg_endo -62.9 175.85 2.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.44 2.093 . . . . 0.0 112.243 179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' ' 583' ' ' SER . 27.1 m -83.3 135.35 34.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.285 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.683 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -70.23 127.16 92.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.586 -179.774 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.44 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 60.4 Cg_exo -51.45 162.01 1.65 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.831 2.354 . . . . 0.0 111.838 179.261 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 8.1 t -159.56 169.41 23.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.279 179.916 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 57.82 33.79 23.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.348 179.653 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.83 HD11 ' HG ' ' A' ' 578' ' ' LEU . 53.9 tp -60.51 158.73 11.65 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.316 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.451 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.5 173.42 14.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.952 0.406 . . . . 0.0 111.553 -179.888 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 3.9 p -129.43 127.48 41.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.372 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.57 -84.18 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.722 -179.53 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -85.71 97.0 9.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.44 -179.591 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.433 ' HB2' HG13 ' A' ' 576' ' ' ILE . 0.5 OUTLIER -118.63 106.41 12.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.718 179.703 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 39.3 p -95.65 -156.63 0.53 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.025 179.972 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 81.2 p -99.34 24.15 8.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.453 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.412 ' O ' HD12 ' A' ' 614' ' ' LEU . 87.4 p -163.95 -42.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.135 -179.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.515 ' HA ' ' O ' ' A' ' 611' ' ' ILE . 0.7 OUTLIER -119.04 128.63 54.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.256 -179.661 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.47 HG22 ' HB ' ' A' ' 611' ' ' ILE . 11.4 tt -119.06 146.47 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 34.6 m -112.19 131.56 55.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.594 179.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.83 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -117.9 146.75 43.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.267 -179.539 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . 0.487 ' O ' HD12 ' A' ' 566' ' ' LEU . 12.5 t -140.91 140.2 34.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.471 179.856 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.498 ' CD2' HG11 ' A' ' 624' ' ' VAL . 40.2 p90 -155.55 169.77 23.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.256 -179.596 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.9 126.17 32.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.119 179.905 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.77 5.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.157 -179.915 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 561' ' ' THR . 3.3 p -72.62 157.49 37.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.945 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.7 -2.84 58.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.444 ' O ' HG23 ' A' ' 589' ' ' VAL . 45.0 m-20 -123.18 54.39 1.26 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 -179.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . 0.552 HD22 ' HB ' ' A' ' 589' ' ' VAL . 17.6 t-20 -74.33 1.5 11.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.947 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.427 HG23 ' H ' ' A' ' 587' ' ' VAL . 3.2 t -60.63 -14.58 9.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.318 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -135.32 -20.04 0.74 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.666 -179.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.589 HG22 ' HB3' ' A' ' 560' ' ' PRO . 23.1 t -56.71 148.42 4.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.676 0.274 . . . . 0.0 110.984 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 19.6 p -130.59 -22.49 2.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.822 -179.565 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . -165.64 179.09 40.17 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.361 -0.923 . . . . 0.0 113.041 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.412 ' CD2' ' HA ' ' A' ' 626' ' ' ALA . 85.9 m-85 -137.12 123.52 20.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.633 0.254 . . . . 0.0 110.884 -179.929 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.616 ' OD1' HD12 ' A' ' 600' ' ' LEU . 0.0 OUTLIER -99.65 128.55 45.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.443 179.467 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.493 HG11 ' HB1' ' A' ' 609' ' ' ALA . 0.2 OUTLIER -103.4 131.65 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.854 -179.972 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 600' ' ' LEU . 95.8 m-85 -99.43 150.44 22.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.651 -179.722 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -134.05 93.53 3.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.653 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . . . . . . . . . . . 55.25 73.79 0.39 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.328 -179.676 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.6 p 47.97 35.93 5.62 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.875 0.369 . . . . 0.0 111.405 -179.68 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -159.98 104.59 1.53 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.122 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.616 HD12 ' OD1' ' A' ' 593' ' ' ASP . 2.0 tt -49.54 121.23 4.87 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.063 -179.879 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -88.2 -101.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.199 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 611' ' ' ILE . 4.5 t -90.67 169.95 10.56 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.18 0.514 . . . . 0.0 111.574 -179.948 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.77 113.94 12.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.362 179.761 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.706 HG11 ' HA ' ' A' ' 609' ' ' ALA . 9.9 m -113.71 -175.17 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.621 -179.172 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.535 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 0.8 OUTLIER -145.26 7.6 1.17 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.807 179.971 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -113.38 -120.68 3.67 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.649 -179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.49 -14.53 7.79 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.69 0.281 . . . . 0.0 111.338 -179.936 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.521 ' O ' HG21 ' A' ' 604' ' ' VAL . 67.6 p -114.09 175.02 5.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.706 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -157.76 126.18 5.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.772 -179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 0.6 OUTLIER -111.47 133.48 53.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.907 0.384 . . . . 0.0 111.46 -179.66 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 575' ' ' SER . 4.4 mp -114.82 135.13 55.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -102.8 178.5 4.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.982 -179.913 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 72.78 -84.75 0.56 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.427 -179.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.494 HD22 HG21 ' A' ' 644' ' ' THR . 5.0 mt 49.58 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 120.9 0.381 . . . . 0.0 111.625 179.348 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . 0.452 ' HB3' ' OH ' ' A' ' 620' ' ' TYR . . . -168.31 111.27 0.59 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.83 179.938 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -60.4 168.76 1.95 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.493 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 58.73 28.5 17.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.284 179.821 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 1.9 m -140.44 148.21 40.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.335 179.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.49 135.0 33.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.452 179.547 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . 0.452 ' OH ' ' HB3' ' A' ' 615' ' ' ALA . 57.6 m-85 -126.54 146.68 50.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.24 0.543 . . . . 0.0 111.981 -179.474 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.15 103.28 6.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -99.47 165.07 11.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.359 0.6 . . . . 0.0 112.031 -178.668 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 2.6 p -151.96 162.9 40.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.144 -0.934 . . . . 0.0 109.805 179.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.706 HG22 HD22 ' A' ' 566' ' ' LEU . 0.0 OUTLIER -125.92 153.6 34.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.953 0.406 . . . . 0.0 111.548 -179.8 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.532 ' HG3' ' HE2' ' A' ' 595' ' ' TYR . 2.7 mmtt -140.36 124.63 17.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.047 -179.71 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 592' ' ' TYR . . . -82.8 100.62 10.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.559 179.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.72 155.08 17.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.012 0.434 . . . . 0.0 111.163 -179.547 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.67 -156.7 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.211 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -49.56 -78.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.647 0.261 . . . . 0.0 111.263 -179.979 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -161.06 48.35 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.517 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . -169.62 9.25 0.05 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.755 -179.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . . . . . . . . . 46.1 m-80 -152.43 131.41 12.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.262 0.531 . . . . 0.0 111.254 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.43 124.47 24.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.735 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 625' ' ' LYS . 93.0 p -67.81 -164.55 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.935 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.683 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -90.44 169.72 10.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.994 179.781 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . . . . . . . . . . . -85.4 137.7 32.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.888 179.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.7 p -73.56 -167.53 0.46 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.08 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -70.89 166.95 20.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -94.96 131.97 40.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.329 -179.871 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . . . . . . . . . 2.2 m -108.21 110.76 33.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.218 -179.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 620' ' ' TYR . 0.3 OUTLIER -88.73 118.5 28.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.85 -179.937 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -132.19 127.46 57.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.175 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -90.03 106.48 18.51 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . 0.494 HG21 HD22 ' A' ' 614' ' ' LEU . 29.8 p . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.219 -179.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 557' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.81 0.338 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 558' ' ' MET . . . . . 0.466 ' HB3' ' ND2' ' A' ' 632' ' ' ASN . 0.0 OUTLIER 66.17 0.93 1.8 Allowed 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.497 179.907 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 559' ' ' ALA . . . . . 0.58 ' HA ' ' HB3' ' A' ' 632' ' ' ASN . . . -82.4 149.57 61.79 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.14 179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 560' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 559' ' ' ALA . 8.6 Cg_endo -86.73 -172.31 0.94 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.212 2.608 . . . . 0.0 112.271 -179.954 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 561' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.74 134.02 36.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.189 179.967 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 562' ' ' ALA . . . . . 0.649 ' HB2' ' H ' ' A' ' 635' ' ' ALA . . . -71.17 132.45 86.26 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 563' ' ' PRO . . . . . 0.515 ' HB3' ' CD1' ' A' ' 580' ' ' TRP . 75.9 Cg_exo -47.61 162.75 0.22 Allowed 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.666 2.244 . . . . 0.0 112.214 179.64 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 564' ' ' THR . . . . . . . . . . . . . 3.7 t -156.11 161.86 40.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.878 0.37 . . . . 0.0 111.319 179.886 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.43 HD22 ' HA ' ' A' ' 565' ' ' ASN . 3.2 m120 58.66 49.3 10.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.472 179.837 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.807 HD11 ' HG ' ' A' ' 578' ' ' LEU . 21.7 tp -75.19 158.27 33.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.376 179.479 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 567' ' ' ALA . . . . . 0.555 ' N ' ' HG ' ' A' ' 566' ' ' LEU . . . -161.52 178.05 9.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.924 0.393 . . . . 0.0 111.448 -179.999 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 568' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.12 129.51 48.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.22 179.442 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 569' ' ' THR . . . . . . . . . . . . . 10.7 p -103.34 -88.88 0.4 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.631 -179.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 570' ' ' ALA . . . . . . . . . . . . . . . -90.21 100.84 13.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.776 0.322 . . . . 0.0 111.33 -179.583 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 571' ' ' GLN . . . . . 0.652 ' HB2' HG13 ' A' ' 576' ' ' ILE . 4.0 tm0? -121.94 129.11 52.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.087 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 5.4 p -115.04 -161.52 0.78 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.766 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 47.5 p -91.55 11.89 22.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.745 0.307 . . . . 0.0 111.425 -179.879 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 574' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 614' ' ' LEU . 52.2 p -145.05 -43.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -112.14 172.46 6.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.583 179.817 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.652 HG13 ' HB2' ' A' ' 571' ' ' GLN . 19.8 tt -160.27 139.59 3.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.379 . . . . 0.0 111.3 179.886 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 577' ' ' THR . . . . . . . . . . . . . 15.1 m -108.13 131.26 54.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.807 ' HG ' HD11 ' A' ' 566' ' ' LEU . 0.4 OUTLIER -114.24 157.04 23.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.946 -179.652 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 579' ' ' SER . . . . . . . . . . . . . 1.6 p -152.28 137.12 17.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.488 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 580' ' ' TRP . . . . . 0.536 ' HH2' HG21 ' A' ' 604' ' ' VAL . 37.3 p90 -156.8 169.71 24.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.961 0.41 . . . . 0.0 111.371 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 581' ' ' THR . . . . . . . . . . . . . 6.9 m -81.18 135.69 35.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.136 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 582' ' ' ALA . . . . . . . . . . . . . . . -64.02 172.45 2.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 67.8 p -83.44 9.62 10.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.918 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 584' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.38 24.68 5.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.231 179.943 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 585' ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' ' 589' ' ' VAL . 5.6 t70 -142.75 45.79 1.59 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 586' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -62.6 -5.55 2.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.261 -179.836 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 5.6 p -76.02 4.19 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.14 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 588' ' ' GLY . . . . . . . . . . . . . . . -150.41 -19.8 0.07 OUTLIER Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.881 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 589' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 585' ' ' ASP . 6.0 t -78.93 136.7 23.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 590' ' ' THR . . . . . . . . . . . . . 41.4 p -106.84 -7.49 17.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.243 -179.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 591' ' ' GLY . . . . . 0.666 ' HA2' ' HA ' ' A' ' 605' ' ' THR . . . 167.15 -179.86 40.56 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.67 179.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.01 128.87 39.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.812 0.339 . . . . 0.0 110.857 179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 593' ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' ' 625' ' ' LYS . 0.7 OUTLIER -103.25 116.76 33.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.809 179.934 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 594' ' ' VAL . . . . . 0.419 ' O ' HD22 ' A' ' 600' ' ' LEU . 0.1 OUTLIER -101.99 136.7 32.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.928 0.394 . . . . 0.0 110.944 179.994 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 595' ' ' TYR . . . . . 0.408 ' HE1' ' HG3' ' A' ' 625' ' ' LYS . 47.7 m-85 -99.4 168.48 9.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.135 -179.657 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 596' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -133.05 84.75 2.16 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.151 179.377 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 597' ' ' GLY . . . . . 0.471 ' O ' HG23 ' A' ' 598' ' ' THR . . . 89.56 -59.86 3.67 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.093 -179.386 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 597' ' ' GLY . 0.6 OUTLIER -161.84 -16.15 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 179.861 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -110.35 136.75 49.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 600' ' ' LEU . . . . . 0.464 HD21 ' HB3' ' A' ' 593' ' ' ASP . 1.3 tm? -55.45 125.44 20.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.826 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 601' ' ' ALA . . . . . . . . . . . . . . . -95.82 -104.87 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.372 -179.724 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 602' ' ' THR . . . . . . . . . . . . . 9.0 t -90.54 165.39 13.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.271 0.558 . . . . 0.0 111.936 -179.397 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 603' ' ' THR . . . . . . . . . . . . . 57.8 m -129.92 128.36 42.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.003 179.405 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 604' ' ' VAL . . . . . 0.722 HG11 ' HA ' ' A' ' 609' ' ' ALA . 11.7 m -127.8 -177.93 2.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.839 0.352 . . . . 0.0 111.713 -179.364 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 605' ' ' THR . . . . . 0.666 ' HA ' ' HA2' ' A' ' 591' ' ' GLY . 72.1 p -137.87 2.04 2.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.878 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 606' ' ' GLY . . . . . . . . . . . . . . . -117.09 -123.11 3.38 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.424 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 607' ' ' THR . . . . . . . . . . . . . 2.0 p -130.6 8.78 4.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.681 0.277 . . . . 0.0 111.165 179.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 608' ' ' THR . . . . . 0.556 ' O ' HG11 ' A' ' 604' ' ' VAL . 40.6 p -130.19 126.18 36.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.266 -179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 609' ' ' ALA . . . . . 0.722 ' HA ' HG11 ' A' ' 604' ' ' VAL . . . -114.51 126.1 54.55 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.247 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 610' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 576' ' ' ILE . 5.6 m -111.8 123.67 50.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.215 179.976 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 611' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 576' ' ' ILE . 4.5 mp -106.56 138.68 30.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.086 -179.982 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 612' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.02 163.46 15.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.823 179.828 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 67.97 68.43 1.65 Allowed Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.436 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 614' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 614' ' ' LEU . 0.0 OUTLIER -123.05 152.5 40.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.336 . . . . 0.0 110.99 -179.819 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 615' ' ' ALA . . . . . . . . . . . . . . . -97.53 155.07 17.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.996 -179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 616' ' ' ALA . . . . . . . . . . . . . . . -90.52 161.89 15.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 617' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 55.54 38.91 30.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.008 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 618' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.13 141.45 36.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.114 179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 619' ' ' SER . . . . . . . . . . . . . 89.9 p -87.7 131.26 34.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.721 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 620' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -124.78 126.78 46.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.366 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 621' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 640' ' ' VAL . 0.1 OUTLIER -106.42 118.56 36.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.29 179.249 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 622' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -111.34 165.11 12.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.21 0.529 . . . . 0.0 112.004 -179.151 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 623' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -155.91 136.53 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.888 179.514 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 624' ' ' VAL . . . . . 0.517 HG11 ' CD2' ' A' ' 580' ' ' TRP . 0.0 OUTLIER -100.58 151.83 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 111.755 -179.297 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 593' ' ' ASP . 4.7 mttt -139.81 157.65 45.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.704 -179.725 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -109.22 145.2 36.25 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.201 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 627' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.11 131.36 26.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.764 179.845 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 628' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.46 169.81 8.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.981 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 629' ' ' ALA . . . . . . . . . . . . . . . -89.57 37.01 0.85 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.022 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -134.98 18.51 3.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.967 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 631' ' ' GLY . . . . . . . . . . . . . . . 68.34 32.21 75.4 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.588 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 632' ' ' ASN . . . . . 0.58 ' HB3' ' HA ' ' A' ' 559' ' ' ALA . 47.5 m-20 -127.57 125.12 39.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.713 0.292 . . . . 0.0 110.915 -179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 633' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -119.77 134.93 61.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.885 -179.838 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 634' ' ' SER . . . . . . . . . . . . . 60.2 p -71.56 -170.51 0.54 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.121 -179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 635' ' ' ALA . . . . . 0.649 ' H ' ' HB2' ' A' ' 562' ' ' ALA . . . -89.7 173.72 8.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.871 179.596 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 636' ' ' ALA . . . . . 0.488 ' HA ' ' HG2' ' A' ' 625' ' ' LYS . . . -83.64 134.43 34.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.971 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 637' ' ' SER . . . . . . . . . . . . . 1.3 t -73.06 -172.21 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.15 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 149.38 49.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.705 179.816 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -84.24 128.0 34.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.197 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 640' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 621' ' ' THR . 12.2 p -103.23 135.87 38.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.91 179.849 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 641' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -106.99 120.1 41.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.93 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.631 HG21 ' HG3' ' A' ' 571' ' ' GLN . 0.7 OUTLIER -122.92 127.27 74.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.95 179.957 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -96.68 103.52 15.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.842 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 644' ' ' THR . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.289 -0.863 . . . . 0.0 111.184 -179.922 . . . . . . . . 0 0 . 1 stop_ save_